All Compounds in Database

Record Name Formula Exact Mass InChIKey Proton NMR Carbon NMR
18955 4-(3-hydroxy-3-methylbutyl)grebustol-B + 4'-(3-hydroxy-3-methylbutyl)grebustol-B 4-(3-hydroxy-3-methylbutyl)grebustol-B + 4'-(3-hydroxy-3-methylbutyl)grebustol-B 4-(3-hydroxy-3-methylbutyl)grebustol-B + 4'-(3-hydroxy-3-methylbutyl)grebustol-B C31H46O5 498.335 InChIKey=WEQXOXQDSPCFTN-XQRVVYSFSA-N No Yes
18956 2,2-dimethyldihydropyranogrebustol-B + iso2,2-dimethyldihydro pyranogrebustol-B 2,2-dimethyldihydropyranogrebustol-B + iso2,2-dimethyldihydro pyranogrebustol-B 2,2-dimethyldihydropyranogrebustol-B + iso2,2-dimethyldihydro pyranogrebustol-B C31H44O5 496.319 InChIKey=OKTLSUQWOZTAIE-XQRVVYSFSA-N No Yes
18958 Macrocarpal K Macrocarpal K Macrocarpal K C28H40O6 472.282 InChIKey=OOAOETHJYYAVCC-BSXRDHGHSA-N No Yes
18959 eudesmanolide eudesmanolide eudesmanolide C23H32O9 452.205 InChIKey=KVHFFLLKCQPXDW-ZVSMCMQZSA-N No Yes
18960 Paludolactone Paludolactone Paludolactone C26H36O9 492.236 InChIKey=MZXMXPYZMSYHPG-WMBPETHRSA-N No Yes
18961 Eucalyptone Eucalyptone Eucalyptone C28H38O7 486.262 InChIKey=KGPNGYABEKLGJP-YGRDELDPSA-N No Yes
18962 Euglobal-G6 Euglobal-G6 Euglobal-G6 C23H30O5 386.209 InChIKey=UKSGQAYAOWHWML-IQMFZBJNSA-N No Yes
18963 Euylobal-G7 Euylobal-G7 Euylobal-G7 C23H30O5 386.209 InChIKey=OUFQMKKQJNJLEE-IQMFZBJNSA-N No Yes
18964 Isogentisin Isogentisin Isogentisin C14H10O5 258.053 InChIKey=FVIYCYAHKMJVJK-UHFFFAOYSA-N No Yes
18966 9H-Xanthen-9-one, 1,7-dihydroxy-2,3-dimethoxy- 9H-Xanthen-9-one, 1,7-dihydroxy-2,3-dimethoxy- 9H-Xanthen-9-one, 1,7-dihydroxy-2,3-dimethoxy- C15H12O6 288.063 InChIKey=BLXIZCDWQXDWQF-UHFFFAOYSA-N No Yes
18967 2,7-Dimethoxy-1,3,6,8-tetrahydroxyxanthone 2,7-Dimethoxy-1,3,6,8-tetrahydroxyxanthone 2,7-Dimethoxy-1,3,6,8-tetrahydroxyxanthone C15H12O8 320.053 InChIKey=LYCMTRLSGDVTRF-UHFFFAOYSA-N No Yes
18969 Euglobal-G8 Euglobal-G8 Euglobal-G8 C23H30O5 386.209 InChIKey=KDIQXRIWYFCIKU-CMJOXMDJSA-N No Yes
18970 Euglobal-G9 Euglobal-G9 Euglobal-G9 C23H30O5 386.209 InChIKey=IWJGCOAIVKYBPU-WZONZLPQSA-N No Yes
18971 Euglobal-G10 Euglobal-G10 Euglobal-G10 C23H30O5 386.209 InChIKey=GOJIPFWYRKXSJU-WZONZLPQSA-N No Yes
18972 Euglobal-G11 Euglobal-G11 Euglobal-G11 C23H30O5 386.209 InChIKey=QNRDYJXKJDDFMZ-WZONZLPQSA-N No Yes
18973 Euglobal-G12 Euglobal-G12 Euglobal-G12 C23H30O5 386.209 InChIKey=AHKVSCVAMJQCBQ-UHFFFAOYSA-N No Yes
18974 (1R,2R,5S)-6,6-Dimethyl-4',6',7',8'-tetrahydrospiro[bicyclo[3.1.1]heptane-2,2'-chromen]-5'(3'H)-one (1R,2R,5S)-6,6-Dimethyl-4',6',7',8'-tetrahydrospiro[bicyclo[3.1.1]heptane-2,2'-chromen]-5'(3'H)-one (1R,2R,5S)-6,6-Dimethyl-4',6',7',8'-tetrahydrospiro[bicyclo[3.1.1]heptane-2,2'-chromen]-5'(3'H)-one C17H24O2 260.178 InChIKey=GZMUPBPHRJFDJO-XQAQDONZSA-N No Yes
18975 C17H24O2 260.178 InChIKey=ZKUHJRMSWMCDTA-PBFPGSCMSA-N No Yes
18976 C17H22O2 258.162 InChIKey=KEFQSYBDMRBOOZ-UXEPBGEESA-N No Yes
18977 Macrocarpal AP Macrocarpal AP Macrocarpal AP C28H40O6 472.282 InChIKey=IBLPTYJTKWQCDX-MOTAWSDJSA-N No Yes
18978 Macrocarpal B Macrocarpal B Macrocarpal B C28H40O6 472.282 InChIKey=IBLPTYJTKWQCDX-NGLILROZSA-N No Yes
18979 Macrocarpal C Macrocarpal C Macrocarpal C C28H38O5 454.272 InChIKey=IEWHEHWXBLPFER-HUCVFKCKSA-N No Yes
18980 Macrocarpal D Macrocarpal D Macrocarpal D C28H40O6 472.282 InChIKey=VUKIJLQDSQXHDI-YSXJIQSGSA-N No Yes
18981 Macrocarpal E Macrocarpal E Macrocarpal E C28H40O6 472.282 InChIKey=XJNGQIYBMXBCRU-UHFFFAOYSA-N No Yes
18982 Eremophila-3,7(11),8-triene-12,8;14,6α-diolide Eremophila-3,7(11),8-triene-12,8;14,6α-diolide Eremophila-3,7(11),8-triene-12,8;14,6α-diolide C15H14O4 258.089 InChIKey=QFJRSCRJWAVYQS-XHYYPMHDSA-N No Yes
18983 3β-[(2-Methylbut-2-enoyl)oxy]eremophil-7(11)-en-12,8β-olid-14-oic 3β-[(2-Methylbut-2-enoyl)oxy]eremophil-7(11)-en-12,8β-olid-14-oic 3β-[(2-Methylbut-2-enoyl)oxy]eremophil-7(11)-en-12,8β-olid-14-oic C20H26O6 362.173 InChIKey=XRNBWDCHEVBWJH-LHKNZVQYSA-N No Yes
18985 (10βH)-8-oxoeremophila-3(4),6(7)-diene-12,14-dioic (10βH)-8-oxoeremophila-3(4),6(7)-diene-12,14-dioic (10βH)-8-oxoeremophila-3(4),6(7)-diene-12,14-dioic C15H18O5 278.115 InChIKey=HBDIRPKYLOSISE-NHJYYFCCSA-N No Yes
18986 (10αH)-8-oxoeremophila-3(4),6(7)-diene-12,14-dioic (10αH)-8-oxoeremophila-3(4),6(7)-diene-12,14-dioic (10αH)-8-oxoeremophila-3(4),6(7)-diene-12,14-dioic C15H18O5 278.115 InChIKey=HBDIRPKYLOSISE-QWTSGDGFSA-N No Yes
18987 8β-[eremophila-3’,7’(11’)-diene-12’,8’α;14’,6’α-diolide]eremophila-3,7(11)-diene-12,8α;14,6α-diolide 8β-[eremophila-3’,7’(11’)-diene-12’,8’α;14’,6’α-diolide]eremophila-3,7(11)-diene-12,8α;14,6α-diolide 8β-[eremophila-3’,7’(11’)-diene-12’,8’α;14’,6’α-diolide]eremophila-3,7(11)-diene-12,8α;14,6α-diolide C30H30O8 518.194 InChIKey=UYXOLHSLRASTJT-XYUQZUCLSA-N No Yes
18988 Ligulatrovine A Ligulatrovine A Ligulatrovine A C28H28O6 460.189 InChIKey=NWOXGKYWAHKTTL-ISLYRVAYSA-N No Yes
18989 1α,8β,10β-trihydroxy-6β-(2-methylacryloyl)oxyeremophil-7(11)-en-8α,12-olide 1α,8β,10β-trihydroxy-6β-(2-methylacryloyl)oxyeremophil-7(11)-en-8α,12-olide 1α,8β,10β-trihydroxy-6β-(2-methylacryloyl)oxyeremophil-7(11)-en-8α,12-olide C19H26O7 366.168 InChIKey=UUMFIBPKUOLWFQ-ZKNBXXKVSA-N No Yes
18990 (1R,4S,5S,6R,8S,10R)-1-acetoxyeremophil-7(11)-en-6,15;8,12-diolide (1R,4S,5S,6R,8S,10R)-1-acetoxyeremophil-7(11)-en-6,15;8,12-diolide (1R,4S,5S,6R,8S,10R)-1-acetoxyeremophil-7(11)-en-6,15;8,12-diolide C17H20O6 320.126 InChIKey=ORKJJZQJJLZNFN-PEAFKYFUSA-N No Yes
18991 (1R,4S,5S,6R,8S,10R)-1-acetoxy-8β-hydroxyeremophil-7(11)-en-6,15;8,12-diolide (1R,4S,5S,6R,8S,10R)-1-acetoxy-8β-hydroxyeremophil-7(11)-en-6,15;8,12-diolide (1R,4S,5S,6R,8S,10R)-1-acetoxy-8β-hydroxyeremophil-7(11)-en-6,15;8,12-diolide C17H20O7 336.121 InChIKey=LRQZOMZNYZRPAR-NCCYPTPYSA-N No Yes
18992 (4S,5S,6R,8R,9S,10S)-8-hydroxy-9-(angeloyloxy)eremophil-7(11)-en-6,15;8,12-diolide (4S,5S,6R,8R,9S,10S)-8-hydroxy-9-(angeloyloxy)eremophil-7(11)-en-6,15;8,12-diolide (4S,5S,6R,8R,9S,10S)-8-hydroxy-9-(angeloyloxy)eremophil-7(11)-en-6,15;8,12-diolide C20H24O7 376.152 InChIKey=FGRQUOULKIBUBJ-ZYKSOYDCSA-N No Yes
18993 (4S,5S,6R,10R)-10-hydroxyeremophil-7(11),8(9)-diene-6,15;8,12-diolide (4S,5S,6R,10R)-10-hydroxyeremophil-7(11),8(9)-diene-6,15;8,12-diolide (4S,5S,6R,10R)-10-hydroxyeremophil-7(11),8(9)-diene-6,15;8,12-diolide C15H16O5 276.100 InChIKey=IAEATVIEIUOMHZ-OYADJFAXSA-N No Yes
18994 (4R)-2-Oxo-3,4abeta-dimethyl-4alpha-[[(Z)-2-methyl-2-butenoyl]oxy]-9aalpha-hydroxy-2,4,4a,5,6,7,8,8abeta,9,9a-decahydronaphtho[2,3-b]furan-5beta-carboxylic acid methyl ester (4R)-2-Oxo-3,4abeta-dimethyl-4alpha-[[(Z)-2-methyl-2-butenoyl]oxy]-9aalpha-hydroxy-2,4,4a,5,6,7,8,8abeta,9,9a-decahydronaphtho[2,3-b]furan-5beta-carboxylic acid methyl ester (4R)-2-Oxo-3,4abeta-dimethyl-4alpha-[[(Z)-2-methyl-2-butenoyl]oxy]-9aalpha-hydroxy-2,4,4a,5,6,7,8,8abeta,9,9a-decahydronaphtho[2,3-b]furan-5beta-carboxylic acid methyl ester C21H28O7 392.184 InChIKey=VOOSWNHYYIUCGL-HIIKNLIRSA-N No Yes
18995 (4R)-2-Oxo-3,4abeta-dimethyl-4alpha-[[(Z)-2-methyl-2-butenoyl]oxy]-9aalpha-ethoxy-2,4,4a,5,6,7,8,8abeta,9,9a-decahydronaphtho[2,3-b]furan-5beta-carboxylic acid (4R)-2-Oxo-3,4abeta-dimethyl-4alpha-[[(Z)-2-methyl-2-butenoyl]oxy]-9aalpha-ethoxy-2,4,4a,5,6,7,8,8abeta,9,9a-decahydronaphtho[2,3-b]furan-5beta-carboxylic acid (4R)-2-Oxo-3,4abeta-dimethyl-4alpha-[[(Z)-2-methyl-2-butenoyl]oxy]-9aalpha-ethoxy-2,4,4a,5,6,7,8,8abeta,9,9a-decahydronaphtho[2,3-b]furan-5beta-carboxylic acid C22H30O7 406.199 InChIKey=LOFFUBZQKBEUDI-YIOGSJBBSA-N No Yes
18996 (4S)-2-Oxo-3,4abeta-dimethyl-4beta-[[(Z)-2-methyl-2-butenoyl]oxy]-9aalpha-ethoxy-2,4,4a,5,6,7,8,8abeta,9,9a-decahydronaphtho[2,3-b]furan-5beta-carboxylic acid (4S)-2-Oxo-3,4abeta-dimethyl-4beta-[[(Z)-2-methyl-2-butenoyl]oxy]-9aalpha-ethoxy-2,4,4a,5,6,7,8,8abeta,9,9a-decahydronaphtho[2,3-b]furan-5beta-carboxylic acid (4S)-2-Oxo-3,4abeta-dimethyl-4beta-[[(Z)-2-methyl-2-butenoyl]oxy]-9aalpha-ethoxy-2,4,4a,5,6,7,8,8abeta,9,9a-decahydronaphtho[2,3-b]furan-5beta-carboxylic acid C22H30O7 406.199 InChIKey=LOFFUBZQKBEUDI-WNPPDQSNSA-N No Yes
18997 3β-(acetyloxy)-6β-(2-methylbutanoyloxy)-10β-hydroxyeremophil-7(11)-en-12,8α-olide 3β-(acetyloxy)-6β-(2-methylbutanoyloxy)-10β-hydroxyeremophil-7(11)-en-12,8α-olide 3β-(acetyloxy)-6β-(2-methylbutanoyloxy)-10β-hydroxyeremophil-7(11)-en-12,8α-olide C22H32O7 408.215 InChIKey=NQUDNNNRNDPWFZ-HGBUQKSKSA-N No Yes
18998 (1R)-1beta,8abeta-Dimethyl-6-oxo-7-acetyl-7alpha,8alpha-epoxy-1,2,3,4,6,7,8,8a-octahydronaphthalene-2beta-ol acetate (1R)-1beta,8abeta-Dimethyl-6-oxo-7-acetyl-7alpha,8alpha-epoxy-1,2,3,4,6,7,8,8a-octahydronaphthalene-2beta-ol acetate (1R)-1beta,8abeta-Dimethyl-6-oxo-7-acetyl-7alpha,8alpha-epoxy-1,2,3,4,6,7,8,8a-octahydronaphthalene-2beta-ol acetate C16H20O5 292.131 InChIKey=IIKXPKBPGMPATO-VXEJCKRLSA-N No Yes
18999 (4aR)-3-Acetyl-4abeta,5beta-dimethyl-6beta-hydroxy-5,6,7,8-tetrahydronaphthalene-2(4aH)-one (4aR)-3-Acetyl-4abeta,5beta-dimethyl-6beta-hydroxy-5,6,7,8-tetrahydronaphthalene-2(4aH)-one (4aR)-3-Acetyl-4abeta,5beta-dimethyl-6beta-hydroxy-5,6,7,8-tetrahydronaphthalene-2(4aH)-one C14H18O3 234.126 InChIKey=COUZLISOMSOQSA-ORUWWINDSA-N No Yes
19000 3β-(3-methylbutanoyloxy)-11-noroxoeremophila-6(7),9(10)-diene-8,11-dione 3β-(3-methylbutanoyloxy)-11-noroxoeremophila-6(7),9(10)-diene-8,11-dione 3β-(3-methylbutanoyloxy)-11-noroxoeremophila-6(7),9(10)-diene-8,11-dione C19H26O4 318.183 InChIKey=NRHWROIRYIUENC-OYYNGEPBSA-N No Yes
19001 Herticins A Herticins A Herticins A C15H22O3 250.157 InChIKey=MVFHOCUIRUKOFG-FFFUXKDYSA-N No Yes
19002 Herticins B Herticins B Herticins B C15H22O4 266.152 InChIKey=VWPXNITVBHRGOA-AGJGQATRSA-N No Yes
19003 (4S)-2-Oxo-3,4abeta,5beta-trimethyl-2,4,4a,5,6,7,8,8a,9,9a-decahydronaphtho[2,3-b]furan-4beta,6beta,8abeta,9aalpha-tetraol 6-acetate (4S)-2-Oxo-3,4abeta,5beta-trimethyl-2,4,4a,5,6,7,8,8a,9,9a-decahydronaphtho[2,3-b]furan-4beta,6beta,8abeta,9aalpha-tetraol 6-acetate (4S)-2-Oxo-3,4abeta,5beta-trimethyl-2,4,4a,5,6,7,8,8a,9,9a-decahydronaphtho[2,3-b]furan-4beta,6beta,8abeta,9aalpha-tetraol 6-acetate C17H24O7 340.152 InChIKey=PKTIIRCZPABZBR-UWDBDOTASA-N No Yes
19004 (4S)-2-Oxo-3,4abeta,5beta-trimethyl-2,4,4a,5,6,7,8,8a-octahydronaphtho[2,3-b]furan-4beta,6beta,8abeta-triol 6-acetate (4S)-2-Oxo-3,4abeta,5beta-trimethyl-2,4,4a,5,6,7,8,8a-octahydronaphtho[2,3-b]furan-4beta,6beta,8abeta-triol 6-acetate (4S)-2-Oxo-3,4abeta,5beta-trimethyl-2,4,4a,5,6,7,8,8a-octahydronaphtho[2,3-b]furan-4beta,6beta,8abeta-triol 6-acetate C17H22O6 322.142 InChIKey=QLBGTECONHIYJH-KLHGTCQHSA-N No Yes
19005 (3β,6β,10α)-3-acetyl-6,10-dihydroxyeremophila-7(11),8-dieno-12,8-lactone (3β,6β,10α)-3-acetyl-6,10-dihydroxyeremophila-7(11),8-dieno-12,8-lactone (3β,6β,10α)-3-acetyl-6,10-dihydroxyeremophila-7(11),8-dieno-12,8-lactone C17H22O6 322.142 InChIKey=QLBGTECONHIYJH-MSKJKSDOSA-N No Yes
19006 (3aR)-2-Acetyl-3abeta,4beta-dimethyl-3a,4,5,6,7,7a-hexahydro-1H-indene-5beta,7abeta-diol 5-acetate (3aR)-2-Acetyl-3abeta,4beta-dimethyl-3a,4,5,6,7,7a-hexahydro-1H-indene-5beta,7abeta-diol 5-acetate (3aR)-2-Acetyl-3abeta,4beta-dimethyl-3a,4,5,6,7,7a-hexahydro-1H-indene-5beta,7abeta-diol 5-acetate C15H22O4 266.152 InChIKey=UVZCTIXFJHDDJL-JVOAXRGISA-N No Yes
19007 TuberculariolA TuberculariolA TuberculariolA C15H20O3 248.141 InChIKey=FEBNZIAHNAHIEF-JTQLQIEISA-N No Yes
19008 TuberculariolB TuberculariolB TuberculariolB C15H20O3 248.141 InChIKey=NJHBOGXWJIZGGR-IIRLODAESA-N No Yes