Exact Mass: 562.3043
Exact Mass Matches: 562.3043
Found 500 metabolites which its exact mass value is equals to given mass value 562.3043
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Apomine
C78281 - Agent Affecting Musculoskeletal System > C67439 - Bone Resorption Inhibitor D050071 - Bone Density Conservation Agents > D004164 - Diphosphonates
Tandutinib
C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor C471 - Enzyme Inhibitor > C1404 - Protein Kinase Inhibitor > C1967 - Tyrosine Kinase Inhibitor C471 - Enzyme Inhibitor > C129825 - Antineoplastic Enzyme Inhibitor
Caseanigrescen C
A diterpenoid of the clerodane group isolated from the leaves and flowers of Casearia nigrescens. It exhibits cytotoxicity against A2780 human ovarian cancer cell line. Caseanigrescen C is a diterpenoid of the clerodane group isolated from the leaves and flowers of Casearia nigrescens. It exhibits cytotoxicity against A2780 human ovarian cancer cell line. It has a role as a metabolite and an antineoplastic agent. It is an acetate ester, a butyrate ester, a cyclic ether, a diterpenoid, an organic heterotricyclic compound and a secondary alcohol.
(1R,3aR,3bS,4aR,6S,7S,7aR,8R,8aR,9aR)-1,4a,8-tris(acetyloxy)-2,2,3b,6,8a-pentamethyl-4,9-dioxo-tetradecahydro-1H-cyclopenta[a]s-indacen-7-yl butanoate
15,17-di-O-acetyl-3-O-cinnamoyl-17-hydroxyjolkinol
3-O-beta-D-Rhamnopyranoside-3,8,12,14-Tetrahydroxybufa-4,20,22-trienolide
3-O-beta-D-Glucopyranoside-3,14,16-Trohydroxybufa-4,20,22-trienolide
(24E)-5alpha-cholest-24-ene-3beta,4beta,6alpha,8,14,15alpha,26-heptaol 15-O-sulfate
4,5-dihydrogaldamycin|4,5-Dihydrogeldanamycin|geldanamycin
(1S,3aR,5S,6R,7S,7aR)-1-(1-acetoxyethyl)octahydro-6-[(2-methylbutanoyl)oxy]-4-methylidene-7-[(2S)-2-methyloxyran-2-yl]-2-oxo-1H-inden-5-yl (2E)-4-acetoxy-3-methylpent-2-enoate
18-ethyloxy-17-hydroxy-17,18-dihydroscrobiculatone B
(22-27)-hexanorcucurbitacin I 2-O-beta-D-glucopyranoside|2,16-dihydroxy-22,23,24,25,26,27-hexanorcucurbit-5-ene-11,20-dione 2-O-beta-glucopyranoside|2-O-beta-D-glucopyranosyl-(22-27)-hexanorcucurbitacin I|khekadaengoside K
26-Sulfate-(3beta,5alpha,6beta,15alpha,16beta,24R,25S)-Ergostane-3,5,6,15,26-hexol
(1alpha,2alpha,3beta,5alpha,6beta)-2,5,8-tris(angeloyloxy)-10,11-epoxy-1,3-dihydroxybisabol-7(14)-en-4-one|(2Z,2Z)-2-methylbut-2-enoic acid rel-(1R,2S,4S,5R,6R)-2-{3-(3,3-dimethyloxxiranyl)-1-methylene-2-{[(2Z)-2-methyl-1-oxobut-2-enyl]oxy}propyl}-2,6-dihydroxy-2-methyl-3-oxocyclohexane-1,4-diyl ester|3alpha,6alpha,9-tris(angeloyloxy)-2alpha,4beta-dihydroxy-7,11-epoxybisabol-10(15)-en-5-one
6alpha-19-diacetoxy-1beta-tigloyloxy-4alpha-18-epoxyneo-clerod-12-en-15-oic acid methylester-16-aldehyde|ajugacumbin J
(20S)-18,20-epoxystrophanthidin-4,6-dideoxy-2,3-methylenedioxy-beta-D-allopyranoside|reevesioside G
3-O-beta-D-glucopyranosylalbicanol-11-O-beta-D-glucopyranoside
6alpha--7beta-<3-methylvaleryloxy>-6,7-desacyloxy-abrotanifolon-13-saeuremethylester
methyl-ent-7alpha,15alpha-diacetoxy-1alpha-(2-methyl-2,3-epoxybutyryloxy)-9alpha-hydroxykaur-16-en-19-oate|methyl-ent-7alpha,15alpha-diacetoxy-1alpha-<2-methyl-2,3-epoxybutyryloxy>-9alpha-hydroxykaur-16-en-19-oate
(1alpha,2alpha,3beta,5alpha,6beta)-1,5,8-tris(angeloyloxy)-10,11-epoxy-2,3-dihydroxybisabol-7(14)-en-4-one|(2Z,2Z)-2-methylbut-2-enoic acid rel-(1R,2S,3S,4S,5R)-2-{3-(3,3-dimethyloxxiranyl)-1-methylene-2-{[(2Z)-2-methyl-1-oxobut-2-enyl]oxy}propyl}-4,5-dihydroxy-5-methyl-6-oxocyclohexane-1,3-diyl ester
18-ethyloxy-17-hydroxy-17,18-dihydroscrobiculatone A
(20S,22R)-12alpha-acetoxy-2alpha,3alpha,6alpha,7alpha-diepoxy-1alpha,5alpha,16alpha,27-tetrahydroxywith-24-enolide|plantagiolide F
28-Sulfate-(3beta,5alpha,6beta,15alpha,24R)-Ergostane-3,5,6,15,24,28-hexol
12-tigloyl-13-(2-methylbutanoyl)-6,7-epoxy-4,5,9,12,13,20-hexahydroxy-1-tigliaen-3-one|EBI-46
Ile Gln Phe Arg
C30H42O10_Butanoic acid, (1R,3aR,3bS,4aR,6S,7S,7aR,8R,8aR,9aR)-1,4a,8-tris(acetyloxy)tetradecahydro-2,2,3b,6,8a-pentamethyl-4,9-dioxo-1H-cyclopent[a]-s-indacen-7-yl ester
(1R,3aR,3bS,4aR,6S,7S,7aR,8R,8aR,9aR)-1,4a,8-tris(acetyloxy)-2,2,3b,6,8a-pentamethyl-4,9-dioxo-tetradecahydro-1H-cyclopenta[a]s-indacen-7-yl butanoate_major
(2S,5R,7R,8R,9S,10S,12S,13R,14S,17R)-17-((R)-5-methoxy-5-oxopentan-2-yl)-10,13-dimethyl-3-oxohexadecahydro-1H-cyclopenta[a]phenanthrene-2,7,12-triyl triacetate
Glu Lys Met Arg
Glu Lys Arg Met
Glu Met Lys Arg
Glu Met Arg Lys
Glu Arg Lys Met
Glu Arg Met Lys
Phe Phe His Ile
Phe Phe His Leu
Phe Phe Ile His
Phe Phe Leu His
Phe His Phe Ile
Phe His Phe Leu
Phe His Ile Phe
Phe His Leu Phe
Phe Ile Phe His
Phe Ile His Phe
Phe Ile Gln Arg
Phe Ile Arg Gln
Phe Leu Phe His
Phe Leu His Phe
Phe Leu Gln Arg
Phe Leu Arg Gln
Phe Gln Ile Arg
Phe Gln Leu Arg
Phe Gln Arg Ile
Phe Gln Arg Leu
Phe Arg Ile Gln
Phe Arg Leu Gln
Phe Arg Gln Ile
Phe Arg Gln Leu
His Phe Phe Ile
His Phe Phe Leu
His Phe Ile Phe
His Phe Leu Phe
His Ile Phe Phe
His Leu Phe Phe
Ile Phe Phe His
Ile Phe His Phe
Ile Phe Gln Arg
Ile Phe Arg Gln
Ile His Phe Phe
Ile Gln Arg Phe
Ile Arg Phe Gln
Ile Arg Gln Phe
Lys Glu Met Arg
Lys Glu Arg Met
Lys Met Glu Arg
Lys Met Arg Glu
Lys Met Val Trp
Lys Met Trp Val
Lys Pro Arg Tyr
Lys Pro Tyr Arg
Lys Arg Glu Met
Lys Arg Met Glu
Lys Arg Pro Tyr
Lys Arg Tyr Pro
Lys Val Met Trp
Lys Val Trp Met
Lys Trp Met Val
Lys Trp Val Met
Lys Tyr Pro Arg
Lys Tyr Arg Pro
Leu Phe Phe His
Leu Phe His Phe
Leu Phe Gln Arg
Leu Phe Arg Gln
Leu His Phe Phe
Leu Gln Phe Arg
Leu Gln Arg Phe
Leu Arg Phe Gln
Leu Arg Gln Phe
Met Glu Lys Arg
Met Glu Arg Lys
Met Lys Glu Arg
Met Lys Arg Glu
Met Lys Val Trp
Met Lys Trp Val
Met Arg Glu Lys
Met Arg Lys Glu
Met Arg Arg Thr
Met Arg Thr Arg
Met Thr Arg Arg
Met Val Lys Trp
Met Val Trp Lys
Met Trp Lys Val
Met Trp Val Lys
Pro Lys Arg Tyr
Pro Lys Tyr Arg
Pro Gln Arg Tyr
Pro Gln Tyr Arg
Pro Arg Lys Tyr
Pro Arg Gln Tyr
Pro Arg Tyr Lys
Pro Arg Tyr Gln
Pro Tyr Lys Arg
Pro Tyr Gln Arg
Pro Tyr Arg Lys
Pro Tyr Arg Gln
Gln Phe Ile Arg
Gln Phe Leu Arg
Gln Phe Arg Ile
Gln Phe Arg Leu
Gln Ile Phe Arg
Gln Ile Arg Phe
Gln Leu Phe Arg
Gln Leu Arg Phe
Gln Pro Arg Tyr
Gln Pro Tyr Arg
Gln Arg Phe Ile
Gln Arg Phe Leu
Gln Arg Ile Phe
Gln Arg Leu Phe
Gln Arg Pro Tyr
Gln Arg Tyr Pro
Gln Tyr Pro Arg
Gln Tyr Arg Pro
Arg Glu Lys Met
Arg Glu Met Lys
Arg Phe Ile Gln
Arg Phe Leu Gln
Arg Phe Gln Ile
Arg Phe Gln Leu
Arg Ile Phe Gln
Arg Ile Gln Phe
Arg Lys Glu Met
Arg Lys Met Glu
Arg Lys Pro Tyr
Arg Lys Tyr Pro
Arg Leu Phe Gln
Arg Leu Gln Phe
Arg Met Glu Lys
Arg Met Lys Glu
Arg Met Arg Thr
Arg Met Thr Arg
Arg Pro Lys Tyr
Arg Pro Gln Tyr
Arg Pro Tyr Lys
Arg Pro Tyr Gln
Arg Gln Phe Ile
Arg Gln Phe Leu
Arg Gln Ile Phe
Arg Gln Leu Phe
Arg Gln Pro Tyr
Arg Gln Tyr Pro
Arg Arg Met Thr
Arg Arg Thr Met
Arg Thr Met Arg
Arg Thr Arg Met
Arg Thr Thr Trp
Arg Thr Trp Thr
Arg Trp Thr Thr
Arg Tyr Lys Pro
Arg Tyr Pro Lys
Arg Tyr Pro Gln
Arg Tyr Gln Pro
Thr Met Arg Arg
Thr Arg Met Arg
Thr Arg Arg Met
Thr Arg Thr Trp
Thr Arg Trp Thr
Thr Thr Arg Trp
Thr Thr Trp Arg
Thr Trp Arg Thr
Thr Trp Thr Arg
Val Lys Met Trp
Val Lys Trp Met
Val Met Lys Trp
Val Met Trp Lys
Val Trp Lys Met
Val Trp Met Lys
Trp Lys Met Val
Trp Lys Val Met
Trp Met Lys Val
Trp Met Val Lys
Trp Arg Thr Thr
Trp Thr Arg Thr
Trp Thr Thr Arg
Trp Val Lys Met
Trp Val Met Lys
Tyr Lys Pro Arg
Tyr Lys Arg Pro
Tyr Pro Lys Arg
Tyr Pro Gln Arg
Tyr Pro Arg Lys
Tyr Pro Arg Gln
Tyr Gln Pro Arg
Tyr Gln Arg Pro
Tyr Arg Lys Pro
Tyr Arg Pro Lys
Tyr Arg Pro Gln
Tyr Arg Gln Pro
Macrolactin O
3beta,11beta-dihydroxy-24,25,26,27-tetranor-cycloart-7-en-23,16beta-olide-3- O-beta-D-xylopyranoside
3-O(alpha-L-rhamnopyranosyl)-3beta,5beta,14beta-trihydroxy-19-oxo-bufa-20,22-dienolide
decanedioic acid,dimethyl benzene-1,4-dicarboxylate,2,2-dimethylpropane-1,3-diol,ethane-1,2-diol
4,5 benzo-1-butyl-1,3,3,3,3-penta-methylindadicarbocyanine tetrafluoroborate
(4-octylphenyl) 2-chloro-4-(4-heptylbenzoyl)oxybenzoate
1-[4-[[4-(dioctylamino)phenyl]diazenyl]-3-nitrophenyl]-2,2,2-trifluoroethanone
Des-N-(methoxycarbonyl)-L-tert-leucine Bis-Boc Atazanavir
Tigilanol tiglate
A diterpenoid natural product isolated from the kernels of the Australian blushwood tree (Fontainea picrosperma). It is approved as a veterinary pharmaceutical for the treatment of non-metastatic and non-resectable canine mast cell tumours. C274 - Antineoplastic Agent > C177298 - Mitochondrial Targeting Antineoplastic Agent
Oleandrigenin monodigitoxoside
A steroid saponin that consists of oleandrigenin having a digitoxosyl residue attached at position 3.
Tandutinib
C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor C471 - Enzyme Inhibitor > C1404 - Protein Kinase Inhibitor > C1967 - Tyrosine Kinase Inhibitor C471 - Enzyme Inhibitor > C129825 - Antineoplastic Enzyme Inhibitor
2-O-methyl-rhamnosyl tetracyclic spinosyn pseudoaglycone
3-[(21S,22S)-16-ethenyl-26-ethyl-4-hydroxy-12,17,21-trimethyl-11-propyl-7,23,24,25-tetrazahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1,3,5,8(26),9,11,13(25),14,16,18(24),19-undecaen-22-yl]propanoic acid
caseanigrescen A
A diterpenoid of the clerodane group isolated from the leaves and flowers of Casearia nigrescens. It exhibits cytotoxicity against A2780 human ovarian cancer cell line.
sodium globostellatate A
An organic sodium salt that is the monosodium of globostellatic acid A. Isolated from the marine sponge Stelletta globostellata, it exhibits cytotoxicity against P-388 murine leukemia cells.
2-methoxy-3,5-dimethyl-6-[(1E,5E,7E,11E)-3,7,9,11-tetramethyl-10-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxytrideca-1,5,7,11-tetraenyl]pyran-4-one
(2S)-2-[[[4-[[[(2S)-1-[(2-methylpropan-2-yl)oxy]-1-oxo-3-phenylpropan-2-yl]amino]-oxomethyl]-1H-imidazol-5-yl]-oxomethyl]amino]-3-phenylpropanoic acid tert-butyl ester
N-[(2R,3S)-2-[[cyclohexylmethyl(methyl)amino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3,5-dimethyl-4-isoxazolesulfonamide
N-[(2S,3R)-2-[[cyclohexylmethyl(methyl)amino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3,5-dimethyl-4-isoxazolesulfonamide
[3-[2,3-dihydroxypropoxy(hydroxy)phosphoryl]oxy-2-hydroxypropyl] (10Z,13Z,16Z)-docosa-10,13,16-trienoate
[1-hydroxy-3-[hydroxy-(3-hydroxy-2-propanoyloxypropoxy)phosphoryl]oxypropan-2-yl] (9Z,12Z,15Z)-octadeca-9,12,15-trienoate
[1-hydroxy-3-[hydroxy-(3-hydroxy-2-pentanoyloxypropoxy)phosphoryl]oxypropan-2-yl] (7Z,10Z,13Z)-hexadeca-7,10,13-trienoate
[1-[2,3-dihydroxypropoxy(hydroxy)phosphoryl]oxy-3-pentanoyloxypropan-2-yl] (7Z,10Z,13Z)-hexadeca-7,10,13-trienoate
[1-[2,3-dihydroxypropoxy(hydroxy)phosphoryl]oxy-3-propanoyloxypropan-2-yl] (9Z,12Z,15Z)-octadeca-9,12,15-trienoate
(2S,5R,7R,8R,9S,10S,12S,13R,14S,17R)-17-((R)-5-methoxy-5-oxopentan-2-yl)-10,13-dimethyl-3-oxohexadecahydro-1H-cyclopenta[a]phenanthrene-2,7,12-triyl triacetate
(1r,2r,13s,15s)-6,8-dihydroxy-13-methoxy-17,17-dimethyl-5,15-bis(3-methylbut-2-en-1-yl)-7-(2-methylbut-3-en-2-yl)-3,16-dioxapentacyclo[11.4.1.0²,¹¹.0²,¹⁵.0⁴,⁹]octadeca-4,6,8,11-tetraene-10,14-dione
5,10,17-trihydroxy-16-{1-[5-(hydroxymethyl)-4-methyl-6-oxo-2,3-dihydropyran-2-yl]ethyl}-11,15-dimethyl-3,8-dioxahexacyclo[10.7.0.0²,⁴.0⁵,¹¹.0⁷,⁹.0¹⁵,¹⁹]nonadecan-14-yl acetate
3-{3a,7,8-trihydroxy-9a,11a-dimethyl-5-oxo-1h,2h,3h,5ah,6h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl}-1-(2,4-dimethyl-5-oxooxolan-3-yl)-3-hydroxybutan-2-yl acetate
(1'r,2s,2'r,8'r,9s,9as,10's,11'r,12's,16's)-2,2',7',7',11',16'-hexamethyl-3,5'-dioxo-2,9a-dihydro-1h-6',15'-dioxaspiro[imidazo[1,2-a]indole-9,14'-tetracyclo[9.7.0.0²,⁸.0¹²,¹⁶]octadecan]-3'-en-10'-yl acetate
(3s,5r)-2-[(1s,2s,3s,4r,6r)-2,4-dihydroxy-4-methyl-3,6-bis({[(2z)-2-methylbut-2-enoyl]oxy})-5-oxocyclohexyl]-5-hydroxy-6-methylhepta-1,6-dien-3-yl (2z)-2-methylbut-2-enoate
4-{8,13,24,25-tetrahydroxy-1-methoxy-5,9,23-trimethyl-2,20,22-trioxahexacyclo[19.3.1.0³,¹⁹.0⁵,¹⁷.0⁶,¹⁴.0⁹,¹³]pentacos-17-en-10-yl}-5h-furan-2-one
2,2',7',7',11',16'-hexamethyl-3,5'-dioxo-2,9a-dihydro-1h-6',15'-dioxaspiro[imidazo[1,2-a]indole-9,14'-tetracyclo[9.7.0.0²,⁸.0¹²,¹⁶]octadecan]-3'-en-10'-yl acetate
(1r,2r,3r,3as,3br,5r,5ar,7s,9ar,9bs,11ar)-2,3,5,5a-tetrahydroxy-1-[(2r,6s)-7-hydroxy-6-methylheptan-2-yl]-9a,11a-dimethyl-tetradecahydrocyclopenta[a]phenanthren-7-yl methyl sulfate
[(1s,3ar,3br,5r,5ar,9ar,9bs,11ar)-1-[(1s)-1-[(2r)-4,5-dimethyl-6-oxo-2,3-dihydropyran-2-yl]-1-hydroxyethyl]-1,3a,5,5a-tetrahydroxy-9a-methyl-9-oxo-2h,3h,3bh,4h,5h,6h,9bh,10h,11h-cyclopenta[a]phenanthren-11a-yl]methyl acetate
3,9,12-tris(acetyloxy)-14-hydroxy-7,11,15,15,16,16-hexamethyl-10-oxotricyclo[9.3.1.1⁴,⁸]hexadeca-1,7-dien-6-yl acetate
{1-[1-(4,5-dimethyl-6-oxo-2,3-dihydropyran-2-yl)-1-hydroxyethyl]-1,3a,5,5a-tetrahydroxy-9a-methyl-9-oxo-2h,3h,3bh,4h,5h,6h,9bh,10h,11h-cyclopenta[a]phenanthren-11a-yl}methyl acetate
5-[(1r,3as,3br,7s,9ar,9bs,11s,11as)-3a,11-dihydroxy-9a,11a-dimethyl-7-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,2h,3h,3bh,4h,5h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl]pyran-2-one
(2r,3r)-3-[(1s,3as,5ar,7r,8r,9ar,9br,11ar)-3a,7,8-trihydroxy-9a,11a-dimethyl-5-oxo-1h,2h,3h,5ah,6h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl]-1-[(2r,3s,4s)-2,4-dimethyl-5-oxooxolan-3-yl]-3-hydroxybutan-2-yl acetate
6-cyclohexyl-7',15'-dihydroxy-5,6',14',16'-tetramethyl-5,6-dihydro-2',20'-dioxaspiro[pyran-2,21'-tricyclo[17.3.1.0⁴,⁹]tricosane]-4',6',8',10',12',16'-hexaen-3'-one
5-(3a,11-dihydroxy-9a,11a-dimethyl-7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,2h,3h,3bh,4h,5h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl)pyran-2-one
(1r,3r,5s,7r,9r,10s,12r,14s,15s,16s,18r,19r,22s,23r)-10,16,22-trihydroxy-9-methoxy-7,14,18-trimethyl-19-(5-oxo-2h-furan-3-yl)-4,6,11-trioxahexacyclo[12.11.0.0³,¹².0⁵,¹⁰.0¹⁵,²³.0¹⁸,²²]pentacosan-17-one
(1s,3ar,5s,6r,7s,7ar)-1-[(1r)-1-(acetyloxy)ethyl]-6-[(2-methylbutanoyl)oxy]-4-methylidene-7-[(2s)-2-methyloxiran-2-yl]-2-oxo-hexahydro-1h-inden-5-yl (2e)-4-(acetyloxy)-3-methylpent-2-enoate
(1r,3as,3br,5as,7s,9as,9bs,11ar)-3a,5a-dihydroxy-11a-methyl-1-(6-oxopyran-3-yl)-7-{[(2r,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}-dodecahydro-1h-cyclopenta[a]phenanthrene-9a-carbaldehyde
5-[(1r,3ar,3bs,7s,9ar,9bs,11r,11as)-3a,3b,11-trihydroxy-9a,11a-dimethyl-7-{[(2r,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}-1h,2h,3h,4h,5h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl]pyran-2-one
(1r,3r,5s,7s,8s,9r,10r,13s)-7,9,10,13-tetrakis(acetyloxy)-8,12,15,15-tetramethyl-4-methylidenetricyclo[9.3.1.0³,⁸]pentadec-11-en-5-yl acetate
(2s,3s,4r,6s,7s,8r,11r)-6-(acetyloxy)-8-(butanoyloxy)-14-[(2r)-1-methoxy-1-oxopropan-2-yl]-3,7,11-trimethyl-15-oxatricyclo[9.3.1.0²,⁷]pentadeca-1(14),12-dien-4-yl butanoate
(1s,2s,4s,5r,7s,9r,10r,11s,12s,14s,15s,16r,17s,19s)-5,10,17-trihydroxy-16-[(1s)-1-[(2r)-5-(hydroxymethyl)-4-methyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-11,15-dimethyl-3,8-dioxahexacyclo[10.7.0.0²,⁴.0⁵,¹¹.0⁷,⁹.0¹⁵,¹⁹]nonadecan-14-yl acetate
2-[5-hydroxy-2-(2-hydroxypropan-2-yl)-7-methoxy-4a,10a-dimethyl-6,9-dioxo-2,3,4,4b,5,11,12,12a-octahydro-1,10-dioxatetraphen-8-yl]-4-methylhexan-3-yl acetate
2-{[8a-methyl-4-methylidene-6-(2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propan-2-yl)-octahydronaphthalen-2-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
n-{2,6-dimethyl-7-[(2-methylbutanoyl)oxy]-8-(4-methylhexyl)-4,9-dioxo-1,5-dioxonan-3-yl}-2-hydroxy-3-[(hydroxymethylidene)amino]benzenecarboximidic acid
1-acetyl-2-hydroxy-3a,6,6,9b,11a-pentamethyl-8-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,2h,3h,3bh,4h,9ah,11h-cyclopenta[a]phenanthrene-7,10-dione
(1e,3s,4s,6s,9r,11s,12s,14s)-3,9,12-tris(acetyloxy)-14-hydroxy-7,11,15,15,16,16-hexamethyl-10-oxotricyclo[9.3.1.1⁴,⁸]hexadeca-1,7-dien-6-yl acetate
(1r,3s,5s,6ar,7s,8r,9r,10s,10ar)-1-(acetyloxy)-3-(butanoyloxy)-9,10-dihydroxy-7,8-dimethyl-7-(3-methylidenepent-4-en-1-yl)-1h,3h,5h,6h,6ah,8h,9h,10h-naphtho[1,8a-c]furan-5-yl 2-methylbutanoate
1-(acetyloxy)-11-[(acetyloxy)methyl]-3,6,6,15-tetramethyl-2-oxotricyclo[11.3.0.0⁵,⁷]hexadeca-3,11-dien-14-yl 3-phenylprop-2-enoate
(3s)-3-[(4as,6s)-2-hydroxy-7,7-dimethyl-4a,6-bis(3-methylbut-2-en-1-yl)-3-(3-methylbutanoyl)-4-oxo-5,6-dihydrochromen-8-yl]-3-phenylpropanoic acid
(1s,3r,5r,6as,7r,8s,9r,10r,10ar)-1,3,9-tris(acetyloxy)-10-hydroxy-7,8-dimethyl-7-(3-methylidenepent-4-en-1-yl)-1h,3h,5h,6h,6ah,8h,9h,10h-naphtho[1,8a-c]furan-5-yl butanoate
(1s,2s,13r,15r)-6,8-dihydroxy-13-methoxy-17,17-dimethyl-5,15-bis(3-methylbut-2-en-1-yl)-7-(2-methylbut-3-en-2-yl)-3,16-dioxapentacyclo[11.4.1.0²,¹¹.0²,¹⁵.0⁴,⁹]octadeca-4,6,8,11-tetraene-10,14-dione
(1s,3r,5r,6as,7s,8s,9r,10r,10as)-1,3,10-tris(acetyloxy)-5-hydroxy-7,8-dimethyl-7-[(2z)-3-methylpenta-2,4-dien-1-yl]-1h,3h,5h,6h,6ah,8h,9h,10h-naphtho[1,8a-c]furan-9-yl butanoate
2-methoxy-3,5-dimethyl-6-[(1e,5e,7e,11e)-3,7,9,11-tetramethyl-10-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}trideca-1,5,7,11-tetraen-1-yl]pyran-4-one
1,3(15),6-farnesatriene-10,11-diol; 10-o-[beta-d-glucopyranosyl(1→4)-beta-d-glucopyranoside]
{"Ingredient_id": "HBIN001000","Ingredient_name": "1,3(15),6-farnesatriene-10,11-diol; 10-o-[beta-d-glucopyranosyl(1\u21924)-beta-d-glucopyranoside]","Alias": "NA","Ingredient_formula": "C27H46O12","Ingredient_Smile": "NA","Ingredient_weight": "0","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "9572","PubChem_id": "NA","DrugBank_id": "NA"}
22-acetylcasterone
{"Ingredient_id": "HBIN003677","Ingredient_name": "22-acetylcasterone","Alias": "NA","Ingredient_formula": "C31H46O9","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "346","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
5alpha-Hydroxy-2alpha-(alpha-methylbutyryl)-oxy-7beta,9alpha,10beta-triacetoxy-4(20),11-taxadiene
{"Ingredient_id": "HBIN011422","Ingredient_name": "5alpha-Hydroxy-2alpha-(alpha-methylbutyryl)-oxy-7beta,9alpha,10beta-triacetoxy-4(20),11-taxadiene","Alias": "5\u03b1-hydroxy-2\u03b1-(\u03b1-methylbutyryl)-oxy-7\u03b2,9\u03b1,10\u03b2-triacetoxy-4(20),11-taxadiene; 5alpha-hydroxy-2alpha-(alpha-methylbutyryl)-oxy-7beta,9alpha,10beta-triacetoxy-4(20),11-taxadiene","Ingredient_formula": "C31H46O9","Ingredient_Smile": "CCC(C)C(=O)OC1C2CCC(=C(C2(C)C)C(C(C3(C1C(=C)C(CC3OC(=O)C)O)C)OC(=O)C)OC(=O)C)C","Ingredient_weight": "562.77","OB_score": "27.89459113","CAS_id": "NA","SymMap_id": "SMIT00866","TCMID_id": "31229;10474","TCMSP_id": "MOL009529","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
9α-hydroxy-14β-(2-methylbutyryl)-oxy-2α,5α,10β-tri acetoxytaxa-4(20),11-diene
{"Ingredient_id": "HBIN014043","Ingredient_name": "9\u03b1-hydroxy-14\u03b2-(2-methylbutyryl)-oxy-2\u03b1,5\u03b1,10\u03b2-tri acetoxytaxa-4(20),11-diene","Alias": "9alpha-hydroxy-14beta-(2-methylbutyryl)oxy-2alpha,5alpha,10beta-triacetoxytaxa-4(20),11-diene","Ingredient_formula": "C31H46O9","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "10475;31230","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
atractyloside d
{"Ingredient_id": "HBIN017304","Ingredient_name": "atractyloside d","Alias": "NA","Ingredient_formula": "C27H46O12","Ingredient_Smile": "CC12CCC(CC1C(=C)CC(C2)OC3C(C(C(C(O3)CO)O)O)O)C(C)(C)OC4C(C(C(C(O4)CO)O)O)O","Ingredient_weight": "562.6 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT14421","TCMID_id": "1977","TCMSP_id": "NA","TCM_ID_id": "6490","PubChem_id": "101831402","DrugBank_id": "NA"}