All Compounds in Database

Record Name Formula Exact Mass InChIKey Proton NMR Carbon NMR
13445 3,4-Secocucurbita-4,24-diene-3,26,29-trioic acid 3,4-Secocucurbita-4,24-diene-3,26,29-trioic acid 3,4-Secocucurbita-4,24-diene-3,26,29-trioic acid C30H46O6 502.329 InChIKey=MLKGNOBMWJPGDM-VXQZCMIRSA-N No Yes
13446 Rulepidadiol Rulepidadiol Rulepidadiol C15H22O3 250.157 InChIKey=GQUVWWKDAFPDRH-TZJKVICWSA-N No Yes
13447 Rulepidatriol Rulepidatriol Rulepidatriol C15H22O4 266.152 InChIKey=DNDJVLRCUVQAAL-RFKXLPOUSA-N No Yes
13448 Lepidamine Lepidamine Lepidamine C15H19N1O3 261.136 InChIKey=CLFDZWJTRTXHNV-MNOMDLKMSA-N No Yes
13449 Gymnomitr-8(12)-en-4-one Gymnomitr-8(12)-en-4-one Gymnomitr-8(12)-en-4-one C15H22O1 218.167 InChIKey=QDOQZVPLNFNMPI-ZQDZILKHSA-N No Yes
13450 3-(15)-Thujopsen-10a-ol 3-(15)-Thujopsen-10a-ol 3-(15)-Thujopsen-10a-ol C15H24O1 220.183 InChIKey=STQUAQUHGIVESS-RJZRQDKASA-N No Yes
13451 1(10)-Aristolene-8b,9b-diol 1(10)-Aristolene-8b,9b-diol 1(10)-Aristolene-8b,9b-diol C15H24O2 236.178 InChIKey=QIAJJBWIXDPSRF-PQQRRUNDSA-N No Yes
13452 Pipeloside A Pipeloside A Pipeloside A C31H52O17 696.320 InChIKey=SQMQVXRQOUEOTA-IVZWGZLRSA-N No Yes
13453 Pipelol A Pipelol A Pipelol A C15H26O3 254.188 InChIKey=DPJNFIIBULGARZ-OOAGNDBOSA-N No Yes
13454 Pipelol A Pipelol A Pipelol A C15H26O3 254.188 InChIKey=DPJNFIIBULGARZ-OOAGNDBOSA-N No Yes
13455 ZINC31155673 ZINC31155673 ZINC31155673 C19H32O7 372.215 InChIKey=NYLNHNDMNOPWAZ-CODAKJSOSA-N No Yes
13456 4(15)-Aromadendren-12,5a-olide 4(15)-Aromadendren-12,5a-olide 4(15)-Aromadendren-12,5a-olide C15H20O2 232.146 InChIKey=UUVXQSJMDIZIBV-IDHVWDFASA-N No Yes
13457 5a,8a-Epidioxy-6-eudesmene 5a,8a-Epidioxy-6-eudesmene 5a,8a-Epidioxy-6-eudesmene C15H24O2 236.178 InChIKey=WSYZXIONTLAKJH-SPWCGHHHSA-N No Yes
13458 3-Acetoxyspathulenol 3-Acetoxyspathulenol 3-Acetoxyspathulenol C17H26O3 278.188 InChIKey=WNMGZFRQTATSEH-CXECBNLGSA-N No Yes
13459 Dendroside A Dendroside A Dendroside A C21H36O8 416.241 InChIKey=MLLIKADUPHWUDA-ULCGBSGMSA-N No Yes
13460 Dendroside A Dendroside A Dendroside A C21H36O8 416.241 InChIKey=MLLIKADUPHWUDA-ULCGBSGMSA-N No Yes
13461 Dendroside A Dendroside A Dendroside A C15H26O3 254.188 InChIKey=XJCYHYLKHMEKAZ-CVEQBJKISA-N No Yes
13462 Dendronobiloside A Dendronobiloside A Dendronobiloside A C27H48O12 564.315 InChIKey=BZZQPBIRQSCVAL-QSTLOTDISA-N No Yes
13463 Dendroside A Dendroside A Dendroside A C15H28O2 240.209 InChIKey=IHZFJOVMTMJUHY-KJWHEZOQSA-N No Yes
13464 Dendronobiloside B Dendronobiloside B Dendronobiloside B C21H38O8 418.257 InChIKey=NSBVLCNEJFYMMI-MQXSHROSSA-N No Yes
13465 Dendronobiloside B Dendronobiloside B Dendronobiloside B C15H28O3 256.204 InChIKey=NSFYSDYUMLKKHU-ZSAUSMIDSA-N No Yes
13466 Acetic acid [(1aS)-1,1,3aalpha,7-tetramethyl-1aalpha,2,3,3a,4,5,7abeta,7balpha-octahydro-1H-cyclopropa[a]naphthalene]-4beta-yl ester Acetic acid [(1aS)-1,1,3aalpha,7-tetramethyl-1aalpha,2,3,3a,4,5,7abeta,7balpha-octahydro-1H-cyclopropa[a]naphthalene]-4beta-yl ester Acetic acid [(1aS)-1,1,3aalpha,7-tetramethyl-1aalpha,2,3,3a,4,5,7abeta,7balpha-octahydro-1H-cyclopropa[a]naphthalene]-4beta-yl ester C17H26O2 262.193 InChIKey=RZFJOHBYVTUAAJ-JBXGNFEISA-N No Yes
13467 (1aS)-1,1,3aalpha,7-Tetramethyl-1aalpha,2,3,3a,4,5,7abeta,7balpha-octahydro-1H-cyclopropa[a]naphthalene-4beta-ol (1aS)-1,1,3aalpha,7-Tetramethyl-1aalpha,2,3,3a,4,5,7abeta,7balpha-octahydro-1H-cyclopropa[a]naphthalene-4beta-ol (1aS)-1,1,3aalpha,7-Tetramethyl-1aalpha,2,3,3a,4,5,7abeta,7balpha-octahydro-1H-cyclopropa[a]naphthalene-4beta-ol C15H24O1 220.183 InChIKey=FCGISFNHEDQGHS-AIUMHDJVSA-N No Yes
13468 (1beta,5alpha,6S,7S)-6,11-Cyclo-4-methylene-15-norambrosane-10-ol (1beta,5alpha,6S,7S)-6,11-Cyclo-4-methylene-15-norambrosane-10-ol (1beta,5alpha,6S,7S)-6,11-Cyclo-4-methylene-15-norambrosane-10-ol C15H24O1 220.183 InChIKey=GHXWXJHYNMHBGF-MJDBTJCESA-N No Yes
13469 (1beta,5alpha,6S,7S)-6,11-Cyclo-4alpha-hydroxy-4-methyl-14,15-dinorambrosane-10-one (1beta,5alpha,6S,7S)-6,11-Cyclo-4alpha-hydroxy-4-methyl-14,15-dinorambrosane-10-one (1beta,5alpha,6S,7S)-6,11-Cyclo-4alpha-hydroxy-4-methyl-14,15-dinorambrosane-10-one C14H22O2 222.162 InChIKey=WGGGLYPWFRDVEK-HPTDNVDKSA-N No Yes
13470 (3S,3aS,6E,10E)-3-Isopropyl-3a,6,10-trimethyl-2,3a,4,8,9,12-hexahydrocyclopenta[11]annulen-5(3H)-one (3S,3aS,6E,10E)-3-Isopropyl-3a,6,10-trimethyl-2,3a,4,8,9,12-hexahydrocyclopenta[11]annulen-5(3H)-one (3S,3aS,6E,10E)-3-Isopropyl-3a,6,10-trimethyl-2,3a,4,8,9,12-hexahydrocyclopenta[11]annulen-5(3H)-one C20H30O1 286.230 InChIKey=CBNJKHFHKYZNCB-LFWPEKJKSA-N No Yes
13471 CHEMBL501287 CHEMBL501287 CHEMBL501287 C20H32O1 288.245 InChIKey=CPCDVXPRDTVABD-ZNNUXXTPSA-N No Yes
13472 (2S,4R,5S,6R,7R)-2-Hydroxy-1(10)-aromadendren-14-oic acid 2,14-lactone (2S,4R,5S,6R,7R)-2-Hydroxy-1(10)-aromadendren-14-oic acid 2,14-lactone (2S,4R,5S,6R,7R)-2-Hydroxy-1(10)-aromadendren-14-oic acid 2,14-lactone C15H20O2 232.146 InChIKey=KSULFOQPZXMUBZ-JEUROIALSA-N No Yes
13473 (2S,4R,5S,6R,7R,9S)-2,9-Dihydroxy-1(10)-aromadendren-14-oic acid 2,14-lactone (2S,4R,5S,6R,7R,9S)-2,9-Dihydroxy-1(10)-aromadendren-14-oic acid 2,14-lactone (2S,4R,5S,6R,7R,9S)-2,9-Dihydroxy-1(10)-aromadendren-14-oic acid 2,14-lactone C15H20O3 248.141 InChIKey=FQWVWVVXBPOQTC-PPOPXYSFSA-N No Yes
13474 (2S,4R,5S,6R,7R,11S)-2,12-Dihydroxy-1(10)-aromadendren-14-oic acid 2,14-lactone (2S,4R,5S,6R,7R,11S)-2,12-Dihydroxy-1(10)-aromadendren-14-oic acid 2,14-lactone (2S,4R,5S,6R,7R,11S)-2,12-Dihydroxy-1(10)-aromadendren-14-oic acid 2,14-lactone C15H20O3 248.141 InChIKey=IYRJQIMYPMMBPF-PSCDZZAVSA-N No Yes
13475 1abeta,2,3,7,7aalpha,7bbeta-Hexahydro-1-(hydroxymethyl)-1alpha,4,7beta-trimethyl-1H-cyclopropa[e]azulene-5(6H)-one 1abeta,2,3,7,7aalpha,7bbeta-Hexahydro-1-(hydroxymethyl)-1alpha,4,7beta-trimethyl-1H-cyclopropa[e]azulene-5(6H)-one 1abeta,2,3,7,7aalpha,7bbeta-Hexahydro-1-(hydroxymethyl)-1alpha,4,7beta-trimethyl-1H-cyclopropa[e]azulene-5(6H)-one C15H22O2 234.162 InChIKey=XJNJKJKMYNGWRW-ZXMBVREDSA-N No Yes
13476 1abeta,2,3,5,6,7,7aalpha,7bbeta-Octahydro-1alpha,4,7beta-trimethyl-5-oxo-1H-cyclopropa[e]azulene-1-carboxylic acid 1abeta,2,3,5,6,7,7aalpha,7bbeta-Octahydro-1alpha,4,7beta-trimethyl-5-oxo-1H-cyclopropa[e]azulene-1-carboxylic acid 1abeta,2,3,5,6,7,7aalpha,7bbeta-Octahydro-1alpha,4,7beta-trimethyl-5-oxo-1H-cyclopropa[e]azulene-1-carboxylic acid C15H20O3 248.141 InChIKey=ZLDWHGMNNJQVOS-FRCJOOGCSA-N No Yes
13477 1abeta,5,6,7,7aalpha,7bbeta-Hexahydro-1-(hydroxymethyl)-1alpha,4,7beta-trimethyl-1H-cyclopropa[e]azulene-3(2H)-one 1abeta,5,6,7,7aalpha,7bbeta-Hexahydro-1-(hydroxymethyl)-1alpha,4,7beta-trimethyl-1H-cyclopropa[e]azulene-3(2H)-one 1abeta,5,6,7,7aalpha,7bbeta-Hexahydro-1-(hydroxymethyl)-1alpha,4,7beta-trimethyl-1H-cyclopropa[e]azulene-3(2H)-one C15H22O2 234.162 InChIKey=FFODVFHYFVHCLI-GNWSSZPXSA-N No Yes
13478 1abeta,2,3,5,6,7,7aalpha,7bbeta-Octahydro-1alpha,4,7beta-trimethyl-3,5-dioxo-1H-cyclopropa[e]azulene-1-carboxylic acid methyl ester 1abeta,2,3,5,6,7,7aalpha,7bbeta-Octahydro-1alpha,4,7beta-trimethyl-3,5-dioxo-1H-cyclopropa[e]azulene-1-carboxylic acid methyl ester 1abeta,2,3,5,6,7,7aalpha,7bbeta-Octahydro-1alpha,4,7beta-trimethyl-3,5-dioxo-1H-cyclopropa[e]azulene-1-carboxylic acid methyl ester C16H20O4 276.136 InChIKey=DVRNYLNCJQKRMR-MSMMXJMOSA-N No Yes
13479 1abeta,2,3,5,6,7,7aalpha,7bbeta-Octahydro-1-(hydroxymethyl)-1alpha,7beta-dimethyl-1H-cyclopropa[e]azulene-4-carbaldehyde 1abeta,2,3,5,6,7,7aalpha,7bbeta-Octahydro-1-(hydroxymethyl)-1alpha,7beta-dimethyl-1H-cyclopropa[e]azulene-4-carbaldehyde 1abeta,2,3,5,6,7,7aalpha,7bbeta-Octahydro-1-(hydroxymethyl)-1alpha,7beta-dimethyl-1H-cyclopropa[e]azulene-4-carbaldehyde C15H22O2 234.162 InChIKey=BRFIUUVWEPSSOT-YGARTUKASA-N No Yes
13480 1abeta,2,3,4,4aalpha,7bbeta-Hexahydro-1-(hydroxymethyl)-1alpha,4beta,7-trimethyl-1H-cyclopropa[e]azulene-6(5H)-one 1abeta,2,3,4,4aalpha,7bbeta-Hexahydro-1-(hydroxymethyl)-1alpha,4beta,7-trimethyl-1H-cyclopropa[e]azulene-6(5H)-one 1abeta,2,3,4,4aalpha,7bbeta-Hexahydro-1-(hydroxymethyl)-1alpha,4beta,7-trimethyl-1H-cyclopropa[e]azulene-6(5H)-one C15H22O2 234.162 InChIKey=FGBKBQYWJICIOF-DBXNAHGSSA-N No Yes
13481 Oxo-cadinol Oxo-cadinol Oxo-cadinol C15H24O2 236.178 InChIKey=XZKNRQNOZWYUMT-RMRHIDDWSA-N No Yes
13482 3-Oxo-T-muurolol 3-Oxo-T-muurolol 3-Oxo-T-muurolol C15H24O2 236.178 InChIKey=XZKNRQNOZWYUMT-PWNZVWSESA-N No Yes
13483 (+)-11-Epispathulenol (+)-11-Epispathulenol (+)-11-Epispathulenol C15H24O1 220.183 InChIKey=FRMCCTDTYSRUBE-KMCWBVRRSA-N No Yes
13484 Plagiochiline 0 Plagiochiline 0 Plagiochiline 0 C21H28O8 408.178 InChIKey=FOECWOWXOWQSLT-GTNVEZLYSA-N No Yes
13485 Plagiochiline P Plagiochiline P Plagiochiline P C21H30O7 394.199 InChIKey=FQGKQKXRLLNYHA-NXMWLWCLSA-N No Yes
13486 Plagiochiline Q Plagiochiline Q Plagiochiline Q C15H20O2 232.146 InChIKey=LXPUJSMWDAWZIJ-BQUFFADESA-N No Yes
13487 Plagiochiline R Plagiochiline R Plagiochiline R C21H28O8 408.178 InChIKey=JHVOFEZRFCOCHL-GHDISZFOSA-N No Yes
13488 4-Hydroxy-3-methoxybenzenepropionic acid [(1R,2S,4S,5R,6E,10S)-4-acetoxy-2-hydroxy-3-methylene-7,11,11-trimethylbicyclo[8.1.0]undec-6-en-5-yl] ester 4-Hydroxy-3-methoxybenzenepropionic acid [(1R,2S,4S,5R,6E,10S)-4-acetoxy-2-hydroxy-3-methylene-7,11,11-trimethylbicyclo[8.1.0]undec-6-en-5-yl] ester 4-Hydroxy-3-methoxybenzenepropionic acid [(1R,2S,4S,5R,6E,10S)-4-acetoxy-2-hydroxy-3-methylene-7,11,11-trimethylbicyclo[8.1.0]undec-6-en-5-yl] ester C27H36O7 472.246 InChIKey=JYVILVWNPBLPON-ZEWCIWHESA-N No Yes
13489 Isoplagiochilide Isoplagiochilide Isoplagiochilide C15H20O2 232.146 InChIKey=IEOQPTYTLIVFRB-GVXVVHGQSA-N No Yes
13490 1H-2-Benzopyran-1-one, 3,4-dihydro-8-hydroxy-3-(4-methoxyphenyl)- 1H-2-Benzopyran-1-one, 3,4-dihydro-8-hydroxy-3-(4-methoxyphenyl)- 1H-2-Benzopyran-1-one, 3,4-dihydro-8-hydroxy-3-(4-methoxyphenyl)- C16H14O4 270.089 InChIKey=DEFIJGJJJKEYGS-UHFFFAOYSA-N No Yes
13491 1,2-Dehydro-3-oxo-β-gurjunene 1,2-Dehydro-3-oxo-β-gurjunene 1,2-Dehydro-3-oxo-β-gurjunene C15H20O1 216.151 InChIKey=KIXJUGBBHBKEHB-LDZXTUBUSA-N No Yes
13492 (+)-3-hydroxyledene (+)-3-hydroxyledene (+)-3-hydroxyledene C15H24O1 220.183 InChIKey=IZONCCDNUJQVJH-HNGSFYKJSA-N No Yes
13493 4,5-dehydroviridiflorol 4,5-dehydroviridiflorol 4,5-dehydroviridiflorol C15H24O1 220.183 InChIKey=OZCCRLYXPIORLS-REJLFOLJSA-N No Yes
13494 ent-4beta-hydroxy-10alpha-methoxyaromadendrane ent-4beta-hydroxy-10alpha-methoxyaromadendrane ent-4beta-hydroxy-10alpha-methoxyaromadendrane C16H28O2 252.209 InChIKey=VIUVKKQOGAFVMN-QNSZCRRISA-N No Yes