All Compounds in Database

Record Name Formula Exact Mass InChIKey Proton NMR Carbon NMR
20426 4-(4-Methyl-1,4-cyclohexadienyl)pentanoic acid 4-(4-Methyl-1,4-cyclohexadienyl)pentanoic acid 4-(4-Methyl-1,4-cyclohexadienyl)pentanoic acid C12H18O2 194.131 InChIKey=HEAYEOGKJIXKLK-SNVBAGLBSA-N No Yes
20427 N-Methoxy, N-methyl 4-(4-methyl-1,4-cyclohexadienyl)pentanoic amide N-Methoxy, N-methyl 4-(4-methyl-1,4-cyclohexadienyl)pentanoic amide N-Methoxy, N-methyl 4-(4-methyl-1,4-cyclohexadienyl)pentanoic amide C14H23N1O2 237.173 InChIKey=HYGKLENLIJHZOZ-GFCCVEGCSA-N No Yes
20428 Methyl (E)-2-methyl-6-(4-methyl-cyclohexa-1,4-dienyl)hept-2-enoate Methyl (E)-2-methyl-6-(4-methyl-cyclohexa-1,4-dienyl)hept-2-enoate Methyl (E)-2-methyl-6-(4-methyl-cyclohexa-1,4-dienyl)hept-2-enoate C16H24O2 248.178 InChIKey=SHLNYIZZOWDHQN-PFLCFFIHSA-N No Yes
20429 (E)-β-curcumen-12-ol (E)-β-curcumen-12-ol (E)-β-curcumen-12-ol C15H22O2 234.162 InChIKey=FQBIQDPAAQNGOA-FIKOHSHLSA-N No Yes
20430 Hymenoic acid Hymenoic acid Hymenoic acid C15H24O4 268.167 InChIKey=LTNNRLSIPOPBOC-YKOULDITSA-N No Yes
20431 Glochinin A Glochinin A Glochinin A C20H22O6 358.142 InChIKey=VXHNARHHEYGPIT-CYBMUJFWSA-N No Yes
20433 1-Oxo-2,3-dihydro-1H-pyrrolizine-7-carbaldehyde 1-Oxo-2,3-dihydro-1H-pyrrolizine-7-carbaldehyde 1-Oxo-2,3-dihydro-1H-pyrrolizine-7-carbaldehyde C8H7N1O2 149.048 InChIKey=PMACSXXWMPSEIU-UHFFFAOYSA-N No Yes
20434 (Z)-2-Methyl-2-butenoic acid 2-[(1R)-2alpha,4alpha,5beta-trihydroxy-3alpha-(angeloyloxy)-4-methylcyclohexane-1alpha-yl]-3,6-dihydroxy-6-methyl-1-heptene-5-yl ester (Z)-2-Methyl-2-butenoic acid 2-[(1R)-2alpha,4alpha,5beta-trihydroxy-3alpha-(angeloyloxy)-4-methylcyclohexane-1alpha-yl]-3,6-dihydroxy-6-methyl-1-heptene-5-yl ester (Z)-2-Methyl-2-butenoic acid 2-[(1R)-2alpha,4alpha,5beta-trihydroxy-3alpha-(angeloyloxy)-4-methylcyclohexane-1alpha-yl]-3,6-dihydroxy-6-methyl-1-heptene-5-yl ester C25H40O9 484.267 InChIKey=LGRBNEWZMTYTSW-VVWVYMMPSA-N No Yes
20435 (6alpha)-2beta-(Angeloyloxy)-4beta-[4-(angeloyloxy)-2,5-dihydroxy-1-methylene-5-methylhexyl]-1alpha-methyl-7-oxabicyclo[4.1.0]heptane-3beta-ol (6alpha)-2beta-(Angeloyloxy)-4beta-[4-(angeloyloxy)-2,5-dihydroxy-1-methylene-5-methylhexyl]-1alpha-methyl-7-oxabicyclo[4.1.0]heptane-3beta-ol (6alpha)-2beta-(Angeloyloxy)-4beta-[4-(angeloyloxy)-2,5-dihydroxy-1-methylene-5-methylhexyl]-1alpha-methyl-7-oxabicyclo[4.1.0]heptane-3beta-ol C25H38O8 466.257 InChIKey=XNXMMOGHWCPTQZ-QMTJVUFESA-N No Yes
20436 (Z)-2-Methyl-2-butenoic acid 2-[(1R)-2alpha,4alpha-dihydroxy-5beta-[[(2S)-2,3beta-dimethyl-5alpha-ethyl-6-oxotetrahydro-2H-pyran-2alpha-yl]carbonyloxy]-3alpha-(angeloyloxy)-4-methylcyclohexane-1alpha-yl]-3,6-dihydroxy-6-methyl-1-heptene-5-yl ester (Z)-2-Methyl-2-butenoic acid 2-[(1R)-2alpha,4alpha-dihydroxy-5beta-[[(2S)-2,3beta-dimethyl-5alpha-ethyl-6-oxotetrahydro-2H-pyran-2alpha-yl]carbonyloxy]-3alpha-(angeloyloxy)-4-methylcyclohexane-1alpha-yl]-3,6-dihydroxy-6-methyl-1-heptene-5-yl ester (Z)-2-Methyl-2-butenoic acid 2-[(1R)-2alpha,4alpha-dihydroxy-5beta-[[(2S)-2,3beta-dimethyl-5alpha-ethyl-6-oxotetrahydro-2H-pyran-2alpha-yl]carbonyloxy]-3alpha-(angeloyloxy)-4-methylcyclohexane-1alpha-yl]-3,6-dihydroxy-6-methyl-1-heptene-5-yl ester C35H54O12 666.362 InChIKey=QJYJTNRVSGPYNE-IFKDYOBDSA-N No Yes
20439 Axinythiocyanate A Axinythiocyanate A Axinythiocyanate A C16H25N1S1 263.171 InChIKey=UDBGTQYSPVXTKN-HOTGVXAUSA-N No Yes
20440 Axinysone A Axinysone A Axinysone A C15H22O2 234.162 InChIKey=KDPNSOLPHGZUAY-NQRSEGCXSA-N No Yes
20441 Axinysone B Axinysone B Axinysone B C15H22O2 234.162 InChIKey=KDPNSOLPHGZUAY-RHVNPFLSSA-N No Yes
20442 Axinysone C Axinysone C Axinysone C C15H22O3 250.157 InChIKey=BMIGITXCSNEZHP-VCKDSHSUSA-N No Yes
20443 Axinysone D Axinysone D Axinysone D C15H24O3 252.173 InChIKey=YIZZSHZWGWWBGE-GUGUHVSSSA-N No Yes
20444 Axinysone E Axinysone E Axinysone E C15H20O2 232.146 InChIKey=VWHKRJDIXZCEGF-YAHBZEKOSA-N No Yes
20445 Axinynitrile A Axinynitrile A Axinynitrile A C16H23N1 229.183 InChIKey=CHWSGROQUOSJCE-OYCUPVHPSA-N No Yes
20446 2beta,4alpha-Bis(angeloyloxy)-3beta-[2-(angeloyloxy)-3-(3,3-dimethyloxiranyl)-1-methylenepropyl]-6alpha-methyl-5beta,6-epoxycyclohexane-1beta-ol 2beta,4alpha-Bis(angeloyloxy)-3beta-[2-(angeloyloxy)-3-(3,3-dimethyloxiranyl)-1-methylenepropyl]-6alpha-methyl-5beta,6-epoxycyclohexane-1beta-ol 2beta,4alpha-Bis(angeloyloxy)-3beta-[2-(angeloyloxy)-3-(3,3-dimethyloxiranyl)-1-methylenepropyl]-6alpha-methyl-5beta,6-epoxycyclohexane-1beta-ol C30H42O9 546.283 InChIKey=POAQTLNAYFDANM-IWYVCLIESA-N No Yes
20447 1β,8-Bisangeloyloxy-3β,4,10,11-bisepoxybisabol-7(14)-en-β-ol 1β,8-Bisangeloyloxy-3β,4,10,11-bisepoxybisabol-7(14)-en-β-ol 1β,8-Bisangeloyloxy-3β,4,10,11-bisepoxybisabol-7(14)-en-β-ol C25H36O7 448.246 InChIKey=AYANXVCAQBIPIH-QMTJVUFESA-N No Yes
20448 8-Angeloyloxy-3β,4β,10,11-bisepoxy-1β-(2-methylbutyryloxy)bisabol7(14)-en-2β-ol- 8-Angeloyloxy-3β,4β,10,11-bisepoxy-1β-(2-methylbutyryloxy)bisabol7(14)-en-2β-ol- 8-Angeloyloxy-3β,4β,10,11-bisepoxy-1β-(2-methylbutyryloxy)bisabol7(14)-en-2β-ol- C25H38O7 450.262 InChIKey=BHFRFWFZCKDMPW-ITVGBHGTSA-N No Yes
20449 (6alpha)-2beta-(Angeloyloxy)-4beta-[2-(angeloyloxy)-1-methylene-3-(3,3-dimethyloxiranyl)propyl]-1alpha-methyl-7-oxabicyclo[4.1.0]heptane-3beta-ol (6alpha)-2beta-(Angeloyloxy)-4beta-[2-(angeloyloxy)-1-methylene-3-(3,3-dimethyloxiranyl)propyl]-1alpha-methyl-7-oxabicyclo[4.1.0]heptane-3beta-ol (6alpha)-2beta-(Angeloyloxy)-4beta-[2-(angeloyloxy)-1-methylene-3-(3,3-dimethyloxiranyl)propyl]-1alpha-methyl-7-oxabicyclo[4.1.0]heptane-3beta-ol C25H36O7 448.246 InChIKey=SOLKVQDUFSZHNA-QMTJVUFESA-N No Yes
20455 Compound 2 Compound 2 Compound 2 C16H16O3 256.110 InChIKey=OCIAKYHUVCXTRR-UHFFFAOYSA-N No Yes
20456 Compound 3 Compound 3 Compound 3 C16H16O3 256.110 InChIKey=YZMOHLCTOWJBTK-UHFFFAOYSA-N No Yes
20457 Compound 4 Compound 4 Compound 4 C21H22O3 322.157 InChIKey=CWWBJDYTFPGMOZ-UHFFFAOYSA-N No Yes
20458 Compound 5 Compound 5 Compound 5 C21H24O3 324.173 InChIKey=OEWWETPWSPQZOM-UHFFFAOYSA-N No Yes
20459 5-benzyloxy-4-methyl-2-(3-methylbut-2-en-1-yl)oxy-1-(1-methyl-1-hydroxybut-3-en-1-yl)benzene 5-benzyloxy-4-methyl-2-(3-methylbut-2-en-1-yl)oxy-1-(1-methyl-1-hydroxybut-3-en-1-yl)benzene 5-benzyloxy-4-methyl-2-(3-methylbut-2-en-1-yl)oxy-1-(1-methyl-1-hydroxybut-3-en-1-yl)benzene C24H30O3 366.219 InChIKey=FUOYCNYITUVSCG-UHFFFAOYSA-N No Yes
20460 alpha,4-Dimethyl-alpha-allyl-2-(1,1-dimethyl-2-propynyloxy)-5-(benzyloxy)benzenemethanol alpha,4-Dimethyl-alpha-allyl-2-(1,1-dimethyl-2-propynyloxy)-5-(benzyloxy)benzenemethanol alpha,4-Dimethyl-alpha-allyl-2-(1,1-dimethyl-2-propynyloxy)-5-(benzyloxy)benzenemethanol C24H28O3 364.204 InChIKey=HNBBBNFGZXKNEU-UHFFFAOYSA-N No Yes
20461 alpha,4-Dimethyl-alpha-allyl-2-(1,1-dimethylallyloxy)-5-(benzyloxy)benzenemethanol alpha,4-Dimethyl-alpha-allyl-2-(1,1-dimethylallyloxy)-5-(benzyloxy)benzenemethanol alpha,4-Dimethyl-alpha-allyl-2-(1,1-dimethylallyloxy)-5-(benzyloxy)benzenemethanol C24H30O3 366.219 InChIKey=XREWMEWDGUPGMJ-UHFFFAOYSA-N No Yes
20462 2-(1-Methyl-3-butenyl)-4-(benzyloxy)-5-methylphenyl 1,1-dimethyl-2-propynyl ether 2-(1-Methyl-3-butenyl)-4-(benzyloxy)-5-methylphenyl 1,1-dimethyl-2-propynyl ether 2-(1-Methyl-3-butenyl)-4-(benzyloxy)-5-methylphenyl 1,1-dimethyl-2-propynyl ether C24H28O2 348.209 InChIKey=XGAXTPXPCKFRRX-UHFFFAOYSA-N No Yes
20463 2-(1-Methyl-3-butenyl)-4-(benzyloxy)-5-methylphenyl 1,1-dimethyl-2-propenyl ether 2-(1-Methyl-3-butenyl)-4-(benzyloxy)-5-methylphenyl 1,1-dimethyl-2-propenyl ether 2-(1-Methyl-3-butenyl)-4-(benzyloxy)-5-methylphenyl 1,1-dimethyl-2-propenyl ether C24H30O2 350.225 InChIKey=GVDNUZCLMDXBEA-UHFFFAOYSA-N No Yes
20464 2,2,6,9-Tetramethyl-8-(benzyloxy)-5,6-dihydro-2H-1-benzoxocin-6-ol 2,2,6,9-Tetramethyl-8-(benzyloxy)-5,6-dihydro-2H-1-benzoxocin-6-ol 2,2,6,9-Tetramethyl-8-(benzyloxy)-5,6-dihydro-2H-1-benzoxocin-6-ol C22H26O3 338.188 InChIKey=ALBGVNTYAJEREO-FLIBITNWSA-N No Yes
20465 2,2,6,9-Tetramethyl-8-(benzyloxy)-5,6-dihydro-2H-1-benzoxocin 2,2,6,9-Tetramethyl-8-(benzyloxy)-5,6-dihydro-2H-1-benzoxocin 2,2,6,9-Tetramethyl-8-(benzyloxy)-5,6-dihydro-2H-1-benzoxocin C22H26O2 322.193 InChIKey=ZTHCVZABWGDFBG-WQLSENKSSA-N No Yes
20466 5-benzyloxy-7-hydroxy-9a,10a-epoxy-7,11-heliannane 5-benzyloxy-7-hydroxy-9a,10a-epoxy-7,11-heliannane 5-benzyloxy-7-hydroxy-9a,10a-epoxy-7,11-heliannane C22H26O4 354.183 InChIKey=STJRLEGGVAWFAD-JAXLGGSGSA-N No Yes
20467 5-benzyloxy-9a,10a-epoxy-7bH,11-heliannane 5-benzyloxy-9a,10a-epoxy-7bH,11-heliannane 5-benzyloxy-9a,10a-epoxy-7bH,11-heliannane C22H26O3 338.188 InChIKey=HYNIWUDXBKCSIF-OREJSRFESA-N No Yes
20468 5-benzyloxy-9a,10a-epoxy-7b-11-heliannane 5-benzyloxy-9a,10a-epoxy-7b-11-heliannane 5-benzyloxy-9a,10a-epoxy-7b-11-heliannane C22H26O3 338.188 InChIKey=HYNIWUDXBKCSIF-WVFSVQOHSA-N No Yes
20469 5-benzyloxy-10a-hydroxy-7aH,11-heliannane 5-benzyloxy-10a-hydroxy-7aH,11-heliannane 5-benzyloxy-10a-hydroxy-7aH,11-heliannane C22H28O3 340.204 InChIKey=KKRCBCQHJRVVRP-BTYIYWSLSA-N No Yes
20470 5-benzyloxy-10a-hydroxy-7bH,11-heliannane 5-benzyloxy-10a-hydroxy-7bH,11-heliannane 5-benzyloxy-10a-hydroxy-7bH,11-heliannane C22H28O3 340.204 InChIKey=KKRCBCQHJRVVRP-VFNWGFHPSA-N No Yes
20471 (3S)-2,2,6alpha,9-Tetramethyl-3,4,5,6-tetrahydro-2H-1-benzoxocin-3beta,8-diol (3S)-2,2,6alpha,9-Tetramethyl-3,4,5,6-tetrahydro-2H-1-benzoxocin-3beta,8-diol (3S)-2,2,6alpha,9-Tetramethyl-3,4,5,6-tetrahydro-2H-1-benzoxocin-3beta,8-diol C15H22O3 250.157 InChIKey=FWVBSUZWRAYTJB-XPTSAGLGSA-N No Yes
20472 Sumadains A Sumadains A Sumadains A C30H34O4 458.246 InChIKey=KBIUSJRYMLTVOW-ZFFBENFFSA-N No Yes
20473 Sumadains B Sumadains B Sumadains B C30H34O4 458.246 InChIKey=NKBUISMJNXPLNL-GMILYPCISA-N No Yes
20474 4b-Hydroxy-6a-benzoyl-7-daucen-9-one 4b-Hydroxy-6a-benzoyl-7-daucen-9-one 4b-Hydroxy-6a-benzoyl-7-daucen-9-one C22H28O4 356.199 InChIKey=UFBJXPDPAABMNR-YVNJGZBMSA-N No Yes
20475 4β,8β-Dihydroxy-6α-benzoyl-dauc-9-ene 4β,8β-Dihydroxy-6α-benzoyl-dauc-9-ene 4β,8β-Dihydroxy-6α-benzoyl-dauc-9-ene C22H30O4 358.214 InChIKey=RLHMEXGBDMGLGZ-ZQONDGBOSA-N No Yes
20476 4β,8β-Dihydroxy-6α-(4-hydroxy-3-methoxybenzoyl)-dauc-9-ene 4β,8β-Dihydroxy-6α-(4-hydroxy-3-methoxybenzoyl)-dauc-9-ene 4β,8β-Dihydroxy-6α-(4-hydroxy-3-methoxybenzoyl)-dauc-9-ene C23H32O6 404.220 InChIKey=VSBPKNDASTZGIN-RNJSZURPSA-N No Yes
20477 4β, 9α-Dihydroxy-6α-benzoyl-dauc-7-ene 4β, 9α-Dihydroxy-6α-benzoyl-dauc-7-ene 4β, 9α-Dihydroxy-6α-benzoyl-dauc-7-ene C22H30O4 358.214 InChIKey=XUBRQXOGVTUWAS-JIWOIOHBSA-N No Yes
20478 Oligandrumin A Oligandrumin A Oligandrumin A C17H24O7 340.152 InChIKey=NGWVVHGYVMUDDC-XSBNRXJRSA-N No Yes
20479 Oligandrumin B Oligandrumin B Oligandrumin B C17H24O7 340.152 InChIKey=OPHFJACTFYATET-PQUSGHHSSA-N No Yes
20480 Oligandrumin C Oligandrumin C Oligandrumin C C15H22O6 298.142 InChIKey=XGDIHMANQAWUOY-SCJJHSOZSA-N No Yes
20481 Oligandrumin D Oligandrumin D Oligandrumin D C15H20O6 296.126 InChIKey=QTRIFUJLMWOHRH-QPSCCSFWSA-N No Yes
20482 Veranisatin D Veranisatin D Veranisatin D C16H22O9 358.126 InChIKey=VWYNCUIYGRLXNS-QYCCGHLNSA-N No Yes
20483 Veranisatin E Veranisatin E Veranisatin E C16H20O10 372.106 InChIKey=KKTVZPCHFKMXRN-FOFYPWIUSA-N No Yes