All Compounds in Database

Record Name Formula Exact Mass InChIKey Proton NMR Carbon NMR
17849 [(1S)-1,5-Dimethyl-1-[(1R)-4-methyl-3-cyclohexene-1beta-yl]-4-hexenyl]amine [(1S)-1,5-Dimethyl-1-[(1R)-4-methyl-3-cyclohexene-1beta-yl]-4-hexenyl]amine [(1S)-1,5-Dimethyl-1-[(1R)-4-methyl-3-cyclohexene-1beta-yl]-4-hexenyl]amine C15H27N1 221.214 InChIKey=QZQOMRYLDNFLCE-GJZGRUSLSA-N No Yes
17850 1α,5β,8α-triacetategermacra-4(15),9(Z),11(13)-trien-6α,12-olide. 1α,5β,8α-triacetategermacra-4(15),9(Z),11(13)-trien-6α,12-olide. 1α,5β,8α-triacetategermacra-4(15),9(Z),11(13)-trien-6α,12-olide. C21H26O8 406.163 InChIKey=UIQWEGXQJBCJNK-YAVGQLGPSA-N No Yes
17852 C22H28O6 388.189 InChIKey=VTBMRZQYAGTEBA-DVOLJVRGSA-N No Yes
17853 (5E)-3,7,11-Trimethyl-10-acetoxy-1,5,11-dodecatriene-3,7-diol (5E)-3,7,11-Trimethyl-10-acetoxy-1,5,11-dodecatriene-3,7-diol (5E)-3,7,11-Trimethyl-10-acetoxy-1,5,11-dodecatriene-3,7-diol C17H28O4 296.199 InChIKey=VUYGYGVRRRWIRQ-DHZHZOJOSA-N No Yes
17854 3'-O-[β-Glucopyranosyl-(1-2)-b-glucopyranosyl]ferukrin 3'-O-[β-Glucopyranosyl-(1-2)-b-glucopyranosyl]ferukrin 3'-O-[β-Glucopyranosyl-(1-2)-b-glucopyranosyl]ferukrin C36H52O15 724.331 InChIKey=OFLXEMCIQLXHKB-HKPFAVOZSA-N No Yes
17855 3α-O-[β-Apiosyl-(1-6)-β-glucopyranosyl]-(5'β,9'α,10α)-8, (12')-drimen-11'yl-umbelliferone 3α-O-[β-Apiosyl-(1-6)-β-glucopyranosyl]-(5'β,9'α,10α)-8, (12')-drimen-11'yl-umbelliferone 3α-O-[β-Apiosyl-(1-6)-β-glucopyranosyl]-(5'β,9'α,10α)-8, (12')-drimen-11'yl-umbelliferone C35H48O14 692.304 InChIKey=VOUHCFIAAIDHES-DUBSNQBFSA-N No Yes
17856 10'-O-[β-Glucopyranosyl-(1-6)-β-glucopyranosyl]karatavicinol 10'-O-[β-Glucopyranosyl-(1-6)-β-glucopyranosyl]karatavicinol 10'-O-[β-Glucopyranosyl-(1-6)-β-glucopyranosyl]karatavicinol C36H52O15 724.331 InChIKey=NTYBUFNMERIJCQ-XNYFVSOYSA-N No Yes
17857 10'-O-[β-Glucopyranosyl-(1-6)-β-glucopyranosyl]karatavicinol 10'-O-[β-Glucopyranosyl-(1-6)-β-glucopyranosyl]karatavicinol 10'-O-[β-Glucopyranosyl-(1-6)-β-glucopyranosyl]karatavicinol C42H62O20 886.383 InChIKey=ISTYTNPHELVUES-ZCHRFIAVSA-N No Yes
17858 Crenulatoside E Crenulatoside E Crenulatoside E C31H50O13 630.325 InChIKey=DORSNXHQDXWTRJ-PCVXSRDCSA-N No Yes
17859 Crenulatoside F Crenulatoside F Crenulatoside F C31H50O13 630.325 InChIKey=JWLPKEJTPBRPTR-PCVXSRDCSA-N No Yes
17860 Crenulatoside G Crenulatoside G Crenulatoside G C31H50O13 630.325 InChIKey=WWKGJIXJAHHSOY-PCVXSRDCSA-N No Yes
17861 Nerolidol-3-O-α-L-rhamnopyranosyl(1-4)-α-L-rhamnopyranosyl(1-2)-[α-L-rhamnopyranosyl(1-6)]-β-D-glucopyranoside Nerolidol-3-O-α-L-rhamnopyranosyl(1-4)-α-L-rhamnopyranosyl(1-2)-[α-L-rhamnopyranosyl(1-6)]-β-D-glucopyranoside Nerolidol-3-O-α-L-rhamnopyranosyl(1-4)-α-L-rhamnopyranosyl(1-2)-[α-L-rhamnopyranosyl(1-6)]-β-D-glucopyranoside C39H66O18 822.425 InChIKey=RTDSIIMUYUALQO-ZEKYDTLHSA-N No Yes
17862 (13R)-2-Oxo-13-hydroxy-1(10),14-ent-halimadien-18-oic acid (13R)-2-Oxo-13-hydroxy-1(10),14-ent-halimadien-18-oic acid (13R)-2-Oxo-13-hydroxy-1(10),14-ent-halimadien-18-oic acid C20H30O4 334.214 InChIKey=WRUUAUYSSLTCMP-NJVWMADFSA-N No Yes
17863 epi-Agelasine C epi-Agelasine C epi-Agelasine C C26H40N5 422.328 InChIKey=AGTCBVBMJBPVIF-KSLJUFOISA-N No Yes
17864 epi-Agelasine C epi-Agelasine C epi-Agelasine C C26H40N5 422.328 InChIKey=AGTCBVBMJBPVIF-KSLJUFOISA-N No Yes
17865 (1S)-1,5,6alpha-Trimethyl-5beta-[(E)-3-methyl-5-(formyloxy)-3-pentenyl]-1,2,3,5,6,7,8,8abeta-octahydronaphthalene-1beta-carboxylic acid methyl ester (1S)-1,5,6alpha-Trimethyl-5beta-[(E)-3-methyl-5-(formyloxy)-3-pentenyl]-1,2,3,5,6,7,8,8abeta-octahydronaphthalene-1beta-carboxylic acid methyl ester (1S)-1,5,6alpha-Trimethyl-5beta-[(E)-3-methyl-5-(formyloxy)-3-pentenyl]-1,2,3,5,6,7,8,8abeta-octahydronaphthalene-1beta-carboxylic acid methyl ester C22H34O4 362.246 InChIKey=DZICGSYWAZOKHD-CYVNUBFGSA-N No Yes
17866 (1S)-1,5,6alpha-Trimethyl-5beta-[(E)-3-methyl-5-[(1-oxopropyl)oxy]-3-pentenyl]-1,2,3,5,6,7,8,8abeta-octahydronaphthalene-1beta-carboxylic acid methyl ester (1S)-1,5,6alpha-Trimethyl-5beta-[(E)-3-methyl-5-[(1-oxopropyl)oxy]-3-pentenyl]-1,2,3,5,6,7,8,8abeta-octahydronaphthalene-1beta-carboxylic acid methyl ester (1S)-1,5,6alpha-Trimethyl-5beta-[(E)-3-methyl-5-[(1-oxopropyl)oxy]-3-pentenyl]-1,2,3,5,6,7,8,8abeta-octahydronaphthalene-1beta-carboxylic acid methyl ester C24H38O4 390.277 InChIKey=KJFKVFSPBVQKJL-WTHAQOGCSA-N No Yes
17867 (1S)-1,5,6alpha-Trimethyl-5beta-[(E)-3-methyl-5-(cis-cinnamoyloxy)-3-pentenyl]-1,2,3,5,6,7,8,8abeta-octahydronaphthalene-1beta-carboxylic acid methyl ester (1S)-1,5,6alpha-Trimethyl-5beta-[(E)-3-methyl-5-(cis-cinnamoyloxy)-3-pentenyl]-1,2,3,5,6,7,8,8abeta-octahydronaphthalene-1beta-carboxylic acid methyl ester (1S)-1,5,6alpha-Trimethyl-5beta-[(E)-3-methyl-5-(cis-cinnamoyloxy)-3-pentenyl]-1,2,3,5,6,7,8,8abeta-octahydronaphthalene-1beta-carboxylic acid methyl ester C30H40O4 464.293 InChIKey=OZTSKZNTXBLLPR-OOZJWYCUSA-N No Yes
17868 (1S)-1,5,6alpha-Trimethyl-5beta-[(E)-3-methyl-5-(trans-cinnamoyloxy)-3-pentenyl]-1,2,3,5,6,7,8,8abeta-octahydronaphthalene-1beta-carboxylic acid methyl ester (1S)-1,5,6alpha-Trimethyl-5beta-[(E)-3-methyl-5-(trans-cinnamoyloxy)-3-pentenyl]-1,2,3,5,6,7,8,8abeta-octahydronaphthalene-1beta-carboxylic acid methyl ester (1S)-1,5,6alpha-Trimethyl-5beta-[(E)-3-methyl-5-(trans-cinnamoyloxy)-3-pentenyl]-1,2,3,5,6,7,8,8abeta-octahydronaphthalene-1beta-carboxylic acid methyl ester C30H40O4 464.293 InChIKey=OZTSKZNTXBLLPR-HTRDCYSXSA-N No Yes
17869 (1S)-1,5,6alpha-Trimethyl-5beta-[(3R)-3-methyl-3-hydroxy-4-pentenyl]-1,2,3,5,6,7,8,8abeta-octahydronaphthalene-1beta-carboxylic acid methyl ester (1S)-1,5,6alpha-Trimethyl-5beta-[(3R)-3-methyl-3-hydroxy-4-pentenyl]-1,2,3,5,6,7,8,8abeta-octahydronaphthalene-1beta-carboxylic acid methyl ester (1S)-1,5,6alpha-Trimethyl-5beta-[(3R)-3-methyl-3-hydroxy-4-pentenyl]-1,2,3,5,6,7,8,8abeta-octahydronaphthalene-1beta-carboxylic acid methyl ester C21H34O3 334.251 InChIKey=FKEHBVIANKGSMS-ONKRVSLGSA-N No Yes
17870 Ent-halima-1(10),13E-dien-15-oic acid Ent-halima-1(10),13E-dien-15-oic acid Ent-halima-1(10),13E-dien-15-oic acid C20H32O2 304.240 InChIKey=MGPKXJKHLWQNJH-UVIZTZHLSA-N No Yes
17871 4-[2-(1,2alpha,5,5-Tetramethyl-1,2,3,4,4abeta,5,6,7-octahydronaphthalene-1beta-yl)ethyl]furan-2(5H)-one 4-[2-(1,2alpha,5,5-Tetramethyl-1,2,3,4,4abeta,5,6,7-octahydronaphthalene-1beta-yl)ethyl]furan-2(5H)-one 4-[2-(1,2alpha,5,5-Tetramethyl-1,2,3,4,4abeta,5,6,7-octahydronaphthalene-1beta-yl)ethyl]furan-2(5H)-one C20H30O2 302.225 InChIKey=UPYCZJSGFYRBFV-IIMJZQEZSA-N No Yes
17872 Methyl-15-tetrahydropyranyloxy-ent-halima-1(10),13E-dien-18-oate Methyl-15-tetrahydropyranyloxy-ent-halima-1(10),13E-dien-18-oate Methyl-15-tetrahydropyranyloxy-ent-halima-1(10),13E-dien-18-oate C26H42O4 418.308 InChIKey=XKEDNWCXJKBYMV-ZQDMEFFWSA-N No Yes
17873 15-Tetrahydropyranyloxy-ent-halima-1(10),13Edien-18-ol 15-Tetrahydropyranyloxy-ent-halima-1(10),13Edien-18-ol 15-Tetrahydropyranyloxy-ent-halima-1(10),13Edien-18-ol C25H42O3 390.313 InChIKey=VWUHXYYIVADEJX-CQOKBXIXSA-N No Yes
17874 15-Tetrahydropyranyloxy-ent-halima-1(10),13E-diene 15-Tetrahydropyranyloxy-ent-halima-1(10),13E-diene 15-Tetrahydropyranyloxy-ent-halima-1(10),13E-diene C25H42O2 374.318 InChIKey=ZYLDWOSDDMYRGO-AFPSKSHTSA-N No Yes
17875 1,5,6alpha-Trimethyl-5beta-[(3E)-3-methyl-5-(tetrahydro-2H-pyran-2-yloxy)-3-pentenyl]-1,2,3,5,6,7,8,8abeta-octahydronaphthalene-1beta-carbaldehyde 1,5,6alpha-Trimethyl-5beta-[(3E)-3-methyl-5-(tetrahydro-2H-pyran-2-yloxy)-3-pentenyl]-1,2,3,5,6,7,8,8abeta-octahydronaphthalene-1beta-carbaldehyde 1,5,6alpha-Trimethyl-5beta-[(3E)-3-methyl-5-(tetrahydro-2H-pyran-2-yloxy)-3-pentenyl]-1,2,3,5,6,7,8,8abeta-octahydronaphthalene-1beta-carbaldehyde C25H40O3 388.298 InChIKey=LZBBLPFHUJDAHR-CQOKBXIXSA-N No Yes
17877 N-Methoxy-N-[(2E)-3-methyl-5-[(1S)-1,2alpha,5,5-tetramethyl-1,2,3,4,4abeta,5,6,7-octahydronaphthalene-1beta-yl]-2-pentenyl]-9-methyl-9H-purine-6-amine N-Methoxy-N-[(2E)-3-methyl-5-[(1S)-1,2alpha,5,5-tetramethyl-1,2,3,4,4abeta,5,6,7-octahydronaphthalene-1beta-yl]-2-pentenyl]-9-methyl-9H-purine-6-amine N-Methoxy-N-[(2E)-3-methyl-5-[(1S)-1,2alpha,5,5-tetramethyl-1,2,3,4,4abeta,5,6,7-octahydronaphthalene-1beta-yl]-2-pentenyl]-9-methyl-9H-purine-6-amine C27H41N5O1 451.331 InChIKey=DCMWZAJLJOIYEV-XTBWPWFWSA-N No Yes
17878 C27H41N5O1 451.331 InChIKey=MURVKNQAMQEJCU-XTBWPWFWSA-N No Yes
17879 (+)-Agelasine C (+)-Agelasine C (+)-Agelasine C C26H40N5 422.328 InChIKey=AGTCBVBMJBPVIF-XYJGDQDWSA-N No Yes
17880 CHEMBL259273 CHEMBL259273 CHEMBL259273 C20H34O3 322.251 InChIKey=UINPBQUOIXYDBI-LRUCAWBZSA-N No Yes
17881 CHEMBL259272 CHEMBL259272 CHEMBL259272 C20H34O3 322.251 InChIKey=VQLARDMEWPYPDR-YUEOBFRXSA-N No Yes
17883 CHEMBL260391 CHEMBL260391 CHEMBL260391 C23H39N1O3 377.293 InChIKey=UFRQKPKMUJPYAC-FKCKUYFUSA-N No Yes
17884 CHEMBL410853 CHEMBL410853 CHEMBL410853 C28H41N1O3 439.309 InChIKey=GMIZPNVASYWNGR-ZEZGLJSWSA-N No Yes
17885 Sarcophytonolide E Sarcophytonolide E Sarcophytonolide E C20H32O3 320.235 InChIKey=ZHOQSUGYUQVEER-MXPJZEDJSA-N No Yes
17886 Sarcophytonolide F Sarcophytonolide F Sarcophytonolide F C20H30O3 318.219 InChIKey=NBRFECPRHLGZRE-QACWMDKXSA-N No Yes
17887 Sarcophytonolide F Sarcophytonolide F Sarcophytonolide F C20H30O3 318.219 InChIKey=NBRFECPRHLGZRE-PTKMSILFSA-N No Yes
17888 Sarcophytonolide H Sarcophytonolide H Sarcophytonolide H C22H32O5 376.225 InChIKey=CBPIZTNTZKKYKN-XEBQGMHGSA-N No Yes
17889 1,15β-Epoxy-2-epi-16-deoxysarcophine 1,15β-Epoxy-2-epi-16-deoxysarcophine 1,15β-Epoxy-2-epi-16-deoxysarcophine C20H30O3 318.219 InChIKey=SINIBGHULULTLM-LWLWWNTNSA-N No Yes
17890 9α-Hydroxy-2-epi-16-deoxysarcophine 9α-Hydroxy-2-epi-16-deoxysarcophine 9α-Hydroxy-2-epi-16-deoxysarcophine C20H30O3 318.219 InChIKey=YCFWYGHHOGCWPB-LQROGWRGSA-N No Yes
17891 10β-Hydroxy-2-epi-16-deoxysarcophine 10β-Hydroxy-2-epi-16-deoxysarcophine 10β-Hydroxy-2-epi-16-deoxysarcophine C20H30O3 318.219 InChIKey=LZVSZONHJCIUBX-ZETDYKMVSA-N No Yes
17892 (1aS,2S,4E,10aS,11E,14aS)-2-Hydroxy-1a,5,8,12-tetramethyl-2,3,6,7,10a,13,14,14a-octahydrooxireno[9,10]cyclotetradeca[1,2-b]furan-9(1aH)-one (1aS,2S,4E,10aS,11E,14aS)-2-Hydroxy-1a,5,8,12-tetramethyl-2,3,6,7,10a,13,14,14a-octahydrooxireno[9,10]cyclotetradeca[1,2-b]furan-9(1aH)-one (1aS,2S,4E,10aS,11E,14aS)-2-Hydroxy-1a,5,8,12-tetramethyl-2,3,6,7,10a,13,14,14a-octahydrooxireno[9,10]cyclotetradeca[1,2-b]furan-9(1aH)-one C20H28O4 332.199 InChIKey=PLXYTNVUDOBBTD-RMDRXMPUSA-N No Yes
17893 14β-Hydroxy-2-epi-16-deoxysarcophine 14β-Hydroxy-2-epi-16-deoxysarcophine 14β-Hydroxy-2-epi-16-deoxysarcophine C20H30O3 318.219 InChIKey=ZLZPIHHAJYNCAU-NZBKKJSSSA-N No Yes
17894 Manaarenolide A Manaarenolide A Manaarenolide A C20H32O6 368.220 InChIKey=LTTQHIVHWORRDE-PKEZZEJYSA-N No Yes
17895 Manaarenolide B Manaarenolide B Manaarenolide B C20H32O6 368.220 InChIKey=LTTQHIVHWORRDE-DUPWDJBLSA-N No Yes
17896 Manaarenolide C Manaarenolide C Manaarenolide C C20H32O5 352.225 InChIKey=DJTJNWAQRPIAEK-PKEZZEJYSA-N No Yes
17897 Manaarenolide B Manaarenolide B Manaarenolide B C20H32O5 352.225 InChIKey=DJTJNWAQRPIAEK-DUPWDJBLSA-N No Yes
17898 Manaarenolide E Manaarenolide E Manaarenolide E C20H32O6 368.220 InChIKey=FHEAMGLYVLIVOJ-LPROGIOKSA-N No Yes
17899 Manaarenolide F Manaarenolide F Manaarenolide F C20H32O6 368.220 InChIKey=FHEAMGLYVLIVOJ-QPOATDBGSA-N No Yes
17900 Manaarenolide G Manaarenolide G Manaarenolide G C20H30O4 334.214 InChIKey=ASSMVNDLURCOIV-YBHGNFEZSA-N No Yes
17901 Manaarenolide H Manaarenolide H Manaarenolide H C20H30O4 334.214 InChIKey=ASSMVNDLURCOIV-CMABJPKZSA-N No Yes