Exact Mass: 472.30494000000004
Exact Mass Matches: 472.30494000000004
Found 500 metabolites which its exact mass value is equals to given mass value 472.30494000000004
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Macrocarpal E
Macrocarpal E is a eudesmane sesquiterpenoid. Macrocarpal E is a natural product found in Eucalyptus amplifolia and Eucalyptus macrocarpa with data available. Macrocarpal E is a constituent of Eucalyptus globulus (Tasmanian blue gum). Constituent of Eucalyptus globulus (Tasmanian blue gum)
Macrocarpal D
Macrocarpal D is a constituent of Eucalyptus globulus (Tasmanian blue gum). Constituent of Eucalyptus globulus (Tasmanian blue gum) Macrocarpal D is a sesquiterpenoid.
(3beta,17alpha,23R)-17,23-Epoxy-3,29-dihydroxy-27-norlanost-8-ene-15,24-dione
(3beta,17alpha,23R)-17,23-Epoxy-3,29-dihydroxy-27-norlanost-8-ene-15,24-dione is found in herbs and spices. (3beta,17alpha,23R)-17,23-Epoxy-3,29-dihydroxy-27-norlanost-8-ene-15,24-dione is a constituent of Muscari comosum (tassel hyacinth)
Macrocarpal B
Macrocarpal B is a constituent of Eucalyptus globulus (Tasmanian blue gum). Constituent of Eucalyptus globulus (Tasmanian blue gum)
Vamonolide
Constituent of the famine food Physalis angulata (cutleaf ground cherry). Vamonolide is found in herbs and spices and fruits. Vamonolide is found in fruits. Vamonolide is a constituent of the famine food Physalis angulata (cutleaf ground cherry).
Ixocarpanolide
Ixocarpanolide is found in fruits. Ixocarpanolide is a constituent of Physalis ixocarpa (tomatillo). Constituent of Physalis ixocarpa (tomatillo). Ixocarpanolide is found in fruits.
(17alpha,23S)-Epoxy-28,29-dihydroxy-27-norlanost-8-ene-3,24-dione
Aglycone from Muscari comosum (tassel hyacinth). (17alpha,23S)-Epoxy-28,29-dihydroxy-27-norlanost-8-ene-3,24-dione is found in herbs and spices. (17alpha,23S)-Epoxy-28,29-dihydroxy-27-norlanost-8-ene-3,24-dione is found in herbs and spices. Aglycone from Muscari comosum (tassel hyacinth
(23S,24S)-17,23-Epoxy-24,29-dihydroxy-27-norlanost-8-ene-3,15-dione
(23S,24S)-17,23-Epoxy-24,29-dihydroxy-27-norlanost-8-ene-3,15-dione is found in herbs and spices. (23S,24S)-17,23-Epoxy-24,29-dihydroxy-27-norlanost-8-ene-3,15-dione is a constituent of Muscari comosum (tassel hyacinth) Constituent of Muscari comosum (tassel hyacinth). (23S,24S)-17,23-Epoxy-24,29-dihydroxy-27-norlanost-8-ene-3,15-dione is found in herbs and spices.
Macrocarpal H
Macrocarpal H is a constituent of Eucalyptus globulus (Tasmanian blue gum). Constituent of Eucalyptus globulus (Tasmanian blue gum)
triterpenoids
DG(2:0/PGF1alpha/0:0)
DG(2:0/PGF1alpha/0:0) belongs to the family of Diacylglycerols. These are glycerolipids lipids containing a common glycerol backbone to which at least one fatty acyl group is esterified. DG(2:0/PGF1alpha/0:0) is also a substrate of diacylglycerol kinase. It is involved in the phospholipid metabolic pathway.
DG(PGF1alpha/2:0/0:0)
DG(PGF1alpha/2:0/0:0) belongs to the family of Diacylglycerols. These are glycerolipids lipids containing a common glycerol backbone to which at least one fatty acyl group is esterified. DG(PGF1alpha/2:0/0:0) is also a substrate of diacylglycerol kinase. It is involved in the phospholipid metabolic pathway.
DG(2:0/0:0/PGF1alpha)
DG(2:0/0:0/PGF1alpha) belongs to the family of Diacylglycerols. These are glycerolipids lipids containing a common glycerol backbone to which at least one fatty acyl group is esterified. It is involved in the phospholipid metabolic pathway.
DG(PGF1alpha/0:0/2:0)
DG(PGF1alpha/0:0/2:0) belongs to the family of Diacylglycerols. These are glycerolipids lipids containing a common glycerol backbone to which at least one fatty acyl group is esterified. It is involved in the phospholipid metabolic pathway.
Dihydrowithaferin A
2,3-dihydrowithaferin A is a withanolide that is the 2,3-dihydro derivative of withaferin A. It has been isolated from the aerial parts of Physalis longifolia. It has a role as a plant metabolite. It is a delta-lactone, a 27-hydroxy steroid, a 4-hydroxy steroid, an ergostanoid, a primary alcohol, a secondary alcohol, a withanolide and an epoxy steroid. It is functionally related to a withaferin A. 2,3-Dihydrowithaferin A is a natural product found in Vassobia breviflora, Withania somnifera, and other organisms with data available. A withanolide that is the 2,3-dihydro derivative of withaferin A. It has been isolated from the aerial parts of Physalis longifolia.
Hecogenin acetate
Hecogenin acetate is a steroidal sapogenin-acetylated with anti-inflammatory and antinociceptive. Hecogenin acetate shows potential antihyperalgesic activity, inhibiting descending pain and acting in opioid receptors[1][2]. Hecogenin acetate is a steroidal sapogenin-acetylated with anti-inflammatory and antinociceptive. Hecogenin acetate shows potential antihyperalgesic activity, inhibiting descending pain and acting in opioid receptors[1][2].
3alpha-(5-methyldodeca-2E,4E,6E-trienoyloxy)-9alpha,13-dihydroxy-10alphaH-eremophil-8-one-8-O-methylacetal|3alpha-<5-methyldodeca-2E,4E,6E-trienoyloxy>-9alpha,13-dihydroxy-10alphaH-eremophil-8-one-8-O-methylacetal
(22R,23S)-17alpha,23-epoxy-22,29-dihydroxy-27-norlanost-8-en-3,24-dione
3alpha-acetoxy-12alpha-hydroxy-20,24-dimethyl-25-norscalar-17-ene-18,24-carbolactone|phyllolactone C
(4beta,17alpha,22R)-4,17,27-Trihydroxy-1-oxowitha-5,24-dienolide
5alpha,6beta,22,27-Tetrahydroxy-1-oxo-ergosta-2,24-dien-26-oic acid 22-lactone, Jaborosalacton D
2alpha,3beta,23-trihydroxy-30-noroleana-12,20-dien-28-oic acid|2??,3??,23-Trihydroxy-30-noroleana-12,20(21)-dien-28-oic acid
(2alpha,19alpha)-2,19-dihydroxy-3-oxo-24-norolean-12-en-28-oic acid
(20S,24S)-20-acetoxy-12beta-hydroxy-20,23-dimethyl-25-norscarlar-17-ene-18,24-carbolactone|20-Ac-12,20-Dihydroxy-20,24-dimethyl-17-scalaren-25,24-olide
2-oxo-3beta,19alpha-dihydroxy-24-nor-urs-12-en-28-oic acid
4beta,20alpha-(R)-Dihydroxy-1-oxo-5beta,6beta-epoxy-with-2-enolid|Anticancer Withanolide PMV70P691-149
Andrastin C
A 17-oxosteroid that is 17-oxo-5beta,9beta,10alpha,13alpha-androsta-11,15-dieneandroxta-11,15-diene which is substituted by an acetoxy group at the 3beta position, methyl groups at the 4, 4, 8, 12, and 16 positions, a methoxycarbonyl group at position 14, and a hydroxy group at position 15. A farnesyltransferase inhibitor produced by Penicillium roqueforti, a filamentous fungus involved in the ripening of several kinds of blue cheeses.
2beta-hydroxy-4,7-diketo-A-norcholest-5-en-2-oic acid ethyl ester
2alpha,3alpha,16alpha-trihydroxy-24-nor-olean-4(23),12-dien-28-oic acid
(1S,4S,5aS,5bR,7aS,11aS,11bR,13aS,13bR)-1,4,5,5a,5b,6,7,7a,8,9,10,11,11a,11b,12,13,13a,13b-octadecahydro-5b,8,8,11a,13a-pentamethylchryseno[1,2-c]furan-1,4-diol diacetate|hyrtiosin E
(Z)-coodeanone B|2-(1-oxo-2-hydroxyethyl)-3-hydroxy-5-(3-methyl-2-butenyloxy)-6-(3-methyl-2-butenyl)-6(S)-(3,7-dimethyl-8-hydroxy-2E,6Z-octadienyl)-2,4-cyclohexadien-1-one
3alpha-acetoxy-21beta-methoxy-24,25,26,27-tetranortirucall-7-ene-23(21)-lactone
(17R,20S,22R,24S,25S,26R)-5alpha,6alpha:22,26:24,25-triepoxy-16alpha,26-dihydroxyergost-2-en-1-one|salpichrolide P
6alpha,7alpha-epoxy-1alpha,3beta,4beta,13beta-tetrahydroxy-24,30-dinorolean-20-ene-28,13beta-olide
3beta,16beta,26,29-tetrahydroxy-5alpha-stigmasta-7,9(11),24(28)(Z)-trien-6-one
(2E,6E,10E)-14,15-dihydroxy-1-(2,5-dimethoxy-3-methylphenyl)-3,7,11,15-tetramethylhexadeca-2,6,10-trien-5-one|cystoazorol A
(20S,22R,24S,25R)-5alpha,24alpha-dihydroxy-6alpha,7alpha-epoxy-1-oxowitha-2-en-26,22-olide|dioscorolide A
(22R)-5beta-formyl-6beta,27-dihydroxy-1-oxo-4-norwith-24-enolide
12alpha-acetoxy-20,24-dimethyl-24-oxoscalar-16-en-25beta-oic acid
4beta,20alpha-dihydroxy-1-oxo-5beta,6beta-epoxy-20R,22R-witha-24-enolide
(25R)-3beta-Acetoxy-5alpha-spirostan-6-on|(25R)-3beta-acetoxy-5alpha-spirostan-6-one
2alpha,3alpha,19alpha-trihydroxy-24-norurs-4(23),12-dien-28-oic acid|2??,3??,19??-Trihydroxy-24-norurs-4(23),12-dien-28-oic acid
3beta,21beta,24-trihydroxy-30-noroleana-12,20(29)-dien-28-oic acid
2alpha,3beta,23-trihydroxy-30-noroleana-12,20(29)-dien-28-oic acid|2??,3??,23-Trihydroxy-30-noroleana-12,20(29)-dien-28-oic acid|Norarjunolic acid|Norarjunolinsaeure
2-ethoxycarbonyl-2beta,6beta-dihydroxy-A-nor-cholesta-5,22(E)-dien-4-one
Ala Val Lys Arg
C20H40N8O5 (472.31215100000003)
Hecogenin acetate
HECOGENIN ACETATE is a triterpenoid. Hecogenin acetate is a steroidal sapogenin-acetylated with anti-inflammatory and antinociceptive. Hecogenin acetate shows potential antihyperalgesic activity, inhibiting descending pain and acting in opioid receptors[1][2]. Hecogenin acetate is a steroidal sapogenin-acetylated with anti-inflammatory and antinociceptive. Hecogenin acetate shows potential antihyperalgesic activity, inhibiting descending pain and acting in opioid receptors[1][2].
Macrocarpal B
Macrocarpal B is a sesquiterpenoid. Macrocarpal B is a natural product found in Eucalyptus sideroxylon, Eucalyptus amplifolia, and other organisms with data available.
MacrocarpalA
Macrocarpal A is a natural product found in Eucalyptus sideroxylon, Eucalyptus amplifolia, and other organisms with data available.
Siraitic Acid A
4_,12-dideoxyphorbol-13-(2,3-dimethyl)butyrate-20-acetate
2,4,6-trihydroxy-5-[1-(4-hydroxy-1,1,4,7-tetramethyl-1a,2,3,4a,5,6,7a,7b-octahydrocyclopropa[h]azulen-7-yl)-3-methylbutyl]benzene-1,3-dicarbaldehyde
2,4,6-trihydroxy-5-[1-(4-hydroxy-1,1,4,7-tetramethyl-1a,2,3,4a,5,6,7a,7b-octahydrocyclopropa[h]azulen-7-yl)-3-methylbutyl]benzene-1,3-dicarbaldehyde
3-Hydroxyspirostan-12-one (3beta,5alpha,25R)-form, Ac
Origin: Plant; SubCategory_DNP: The sterols, Cholestanes
Ala Ala Arg Arg
Ala Lys Arg Val
C20H40N8O5 (472.31215100000003)
Ala Lys Val Arg
C20H40N8O5 (472.31215100000003)
Ala Arg Ala Arg
Ala Arg Lys Val
C20H40N8O5 (472.31215100000003)
Ala Arg Arg Ala
Ala Arg Val Lys
C20H40N8O5 (472.31215100000003)
Ala Val Arg Lys
C20H40N8O5 (472.31215100000003)
Asp Ile Ile Ile
Asp Ile Ile Leu
Asp Ile Leu Ile
Asp Ile Leu Leu
Asp Leu Ile Ile
Asp Leu Ile Leu
Asp Leu Leu Ile
Asp Leu Leu Leu
Glu Ile Ile Val
Glu Ile Leu Val
Glu Ile Val Ile
Glu Ile Val Leu
Glu Leu Ile Val
Glu Leu Leu Val
Glu Leu Val Ile
Glu Leu Val Leu
Glu Val Ile Ile
Glu Val Ile Leu
Glu Val Leu Ile
Glu Val Leu Leu
Gly Ile Lys Arg
C20H40N8O5 (472.31215100000003)
Gly Ile Arg Lys
C20H40N8O5 (472.31215100000003)
Gly Lys Ile Arg
C20H40N8O5 (472.31215100000003)
Gly Lys Leu Arg
C20H40N8O5 (472.31215100000003)
Gly Lys Arg Ile
C20H40N8O5 (472.31215100000003)
Gly Lys Arg Leu
C20H40N8O5 (472.31215100000003)
Gly Leu Lys Arg
C20H40N8O5 (472.31215100000003)
Gly Leu Arg Lys
C20H40N8O5 (472.31215100000003)
Gly Arg Ile Lys
C20H40N8O5 (472.31215100000003)
Gly Arg Lys Ile
C20H40N8O5 (472.31215100000003)
Gly Arg Lys Leu
C20H40N8O5 (472.31215100000003)
Gly Arg Leu Lys
C20H40N8O5 (472.31215100000003)
Ile Asp Ile Ile
Ile Asp Ile Leu
Ile Asp Leu Ile
Ile Asp Leu Leu
Ile Glu Ile Val
Ile Glu Leu Val
Ile Glu Val Ile
Ile Glu Val Leu
Ile Gly Lys Arg
C20H40N8O5 (472.31215100000003)
Ile Gly Arg Lys
C20H40N8O5 (472.31215100000003)
Ile Ile Asp Ile
Ile Ile Asp Leu
Ile Ile Glu Val
Ile Ile Ile Asp
Ile Ile Leu Asp
Ile Ile Val Glu
Ile Lys Gly Arg
C20H40N8O5 (472.31215100000003)
Ile Lys Asn Val
Ile Lys Arg Gly
C20H40N8O5 (472.31215100000003)
Ile Lys Val Asn
Ile Leu Asp Ile
Ile Leu Asp Leu
Ile Leu Glu Val
Ile Leu Ile Asp
Ile Leu Leu Asp
Ile Leu Val Glu
Ile Asn Lys Val
Ile Asn Val Lys
Ile Arg Gly Lys
C20H40N8O5 (472.31215100000003)
Ile Arg Lys Gly
C20H40N8O5 (472.31215100000003)
Ile Val Glu Ile
Ile Val Glu Leu
Ile Val Ile Glu
Ile Val Lys Asn
Ile Val Leu Glu
Ile Val Asn Lys
Lys Ala Arg Val
C20H40N8O5 (472.31215100000003)
Lys Ala Val Arg
C20H40N8O5 (472.31215100000003)
Lys Gly Ile Arg
C20H40N8O5 (472.31215100000003)
Lys Gly Leu Arg
C20H40N8O5 (472.31215100000003)
Lys Gly Arg Ile
C20H40N8O5 (472.31215100000003)
Lys Gly Arg Leu
C20H40N8O5 (472.31215100000003)
Lys Ile Gly Arg
C20H40N8O5 (472.31215100000003)
Lys Ile Asn Val
Lys Ile Arg Gly
C20H40N8O5 (472.31215100000003)
Lys Ile Val Asn
Lys Lys Pro Thr
Lys Lys Thr Pro
Lys Leu Gly Arg
C20H40N8O5 (472.31215100000003)
Lys Leu Asn Val
Lys Leu Arg Gly
C20H40N8O5 (472.31215100000003)
Lys Leu Val Asn
Lys Asn Ile Val
Lys Asn Leu Val
Lys Asn Val Ile
Lys Asn Val Leu
Lys Pro Lys Thr
Lys Pro Thr Lys
Lys Gln Val Val
Lys Arg Ala Val
C20H40N8O5 (472.31215100000003)
Lys Arg Gly Ile
C20H40N8O5 (472.31215100000003)
Lys Arg Gly Leu
C20H40N8O5 (472.31215100000003)
Lys Arg Ile Gly
C20H40N8O5 (472.31215100000003)
Lys Arg Leu Gly
C20H40N8O5 (472.31215100000003)
Lys Arg Val Ala
C20H40N8O5 (472.31215100000003)
Lys Thr Lys Pro
Lys Thr Pro Lys
Lys Val Ala Arg
C20H40N8O5 (472.31215100000003)
Lys Val Ile Asn
Lys Val Leu Asn
Lys Val Asn Ile
Lys Val Asn Leu
Lys Val Gln Val
Lys Val Arg Ala
C20H40N8O5 (472.31215100000003)
Lys Val Val Gln
Leu Asp Ile Ile
Leu Asp Ile Leu
Leu Asp Leu Ile
Leu Asp Leu Leu
Leu Glu Ile Val
Leu Glu Leu Val
Leu Glu Val Ile
Leu Glu Val Leu
Leu Gly Lys Arg
C20H40N8O5 (472.31215100000003)
Leu Gly Arg Lys
C20H40N8O5 (472.31215100000003)
Leu Ile Asp Ile
Leu Ile Asp Leu
Leu Ile Glu Val
Leu Ile Ile Asp
Leu Ile Leu Asp
Leu Ile Val Glu
Leu Lys Gly Arg
C20H40N8O5 (472.31215100000003)
Leu Lys Asn Val
Leu Lys Arg Gly
C20H40N8O5 (472.31215100000003)
Leu Lys Val Asn
Leu Leu Asp Ile
Leu Leu Asp Leu
Leu Leu Glu Val
Leu Leu Ile Asp
Leu Leu Leu Asp
Leu Leu Val Glu
Leu Asn Lys Val
Leu Asn Val Lys
Leu Arg Gly Lys
C20H40N8O5 (472.31215100000003)
Leu Arg Lys Gly
C20H40N8O5 (472.31215100000003)
Leu Val Glu Ile
Leu Val Glu Leu
Leu Val Ile Glu
Leu Val Lys Asn
Leu Val Leu Glu
Leu Val Asn Lys
Asn Ile Lys Val
Asn Ile Val Lys
Asn Lys Ile Val
Asn Lys Leu Val
Asn Lys Val Ile
Asn Lys Val Leu
Asn Leu Lys Val
Asn Leu Val Lys
Asn Val Ile Lys
Asn Val Lys Ile
Asn Val Lys Leu
Asn Val Leu Lys
Pro Lys Lys Thr
Pro Lys Thr Lys
Pro Thr Lys Lys
Gln Lys Val Val
Gln Val Lys Val
Gln Val Val Lys
Arg Ala Ala Arg
Arg Ala Lys Val
C20H40N8O5 (472.31215100000003)
Arg Ala Arg Ala
Arg Ala Val Lys
C20H40N8O5 (472.31215100000003)
Arg Gly Ile Lys
C20H40N8O5 (472.31215100000003)
Arg Gly Lys Ile
C20H40N8O5 (472.31215100000003)
Arg Gly Lys Leu
C20H40N8O5 (472.31215100000003)
Arg Gly Leu Lys
C20H40N8O5 (472.31215100000003)
Arg Ile Gly Lys
C20H40N8O5 (472.31215100000003)
Arg Ile Lys Gly
C20H40N8O5 (472.31215100000003)
Arg Lys Ala Val
C20H40N8O5 (472.31215100000003)
Arg Lys Gly Ile
C20H40N8O5 (472.31215100000003)
Arg Lys Gly Leu
C20H40N8O5 (472.31215100000003)
Arg Lys Ile Gly
C20H40N8O5 (472.31215100000003)
Arg Lys Leu Gly
C20H40N8O5 (472.31215100000003)
Arg Lys Val Ala
C20H40N8O5 (472.31215100000003)
Arg Leu Gly Lys
C20H40N8O5 (472.31215100000003)
Arg Leu Lys Gly
C20H40N8O5 (472.31215100000003)
Arg Arg Ala Ala
Arg Val Ala Lys
C20H40N8O5 (472.31215100000003)
Arg Val Lys Ala
C20H40N8O5 (472.31215100000003)
Thr Lys Lys Pro
Thr Lys Pro Lys
Thr Pro Lys Lys
Val Ala Lys Arg
C20H40N8O5 (472.31215100000003)
Val Ala Arg Lys
C20H40N8O5 (472.31215100000003)
Val Glu Ile Ile
Val Glu Ile Leu
Val Glu Leu Ile
Val Glu Leu Leu
Val Ile Glu Ile
Val Ile Glu Leu
Val Ile Ile Glu
Val Ile Lys Asn
Val Ile Leu Glu
Val Ile Asn Lys
Val Lys Ala Arg
C20H40N8O5 (472.31215100000003)
Val Lys Ile Asn
Val Lys Leu Asn
Val Lys Asn Ile
Val Lys Asn Leu
Val Lys Gln Val
Val Lys Arg Ala
C20H40N8O5 (472.31215100000003)
Val Lys Val Gln
Val Leu Glu Ile
Val Leu Glu Leu
Val Leu Ile Glu
Val Leu Lys Asn
Val Leu Leu Glu
Val Leu Asn Lys
Val Asn Ile Lys
Val Asn Lys Ile
Val Asn Lys Leu
Val Asn Leu Lys
Val Gln Lys Val
Val Gln Val Lys
Val Arg Ala Lys
C20H40N8O5 (472.31215100000003)
Val Arg Lys Ala
C20H40N8O5 (472.31215100000003)
Val Val Lys Gln
Val Val Gln Lys
Ixocarpanolide
(3beta,17alpha,23R)-17,23-Epoxy-3,29-dihydroxy-27-norlanost-8-ene-15,24-dione
17a,23S-Epoxy-28,29-dihydroxy-27-norlanost-8-ene-3,24-dione
(23S,24S)-17,23-Epoxy-24,29-dihydroxy-27-norlanost-8-ene-3,15-dione
Vamonolide
Macrocarpal D
Macrocarpal E
macrocarpal H
ST 28:5;O6
2,2-bis[[(1-oxopentyl)oxy]methyl]propane-1,3-diyl divalerate
N9,N10-BIS(4-BUTYLPHENYL)PHENANTHRENE-9,10-DIAMINE
2,4,6-Trihydroxy-5-[1-(4-hydroxy-1,1,4,7-tetramethyl-1a,2,3,4a,5,6,7a,7b-octahydrocyclopropa[h]azulen-7-yl)-3-methylbutyl]benzene-1,3-dicarbaldehyde
Spirostan-12-one, 3-(acetyloxy)-, (3beta,5alpha,25R)-
N-[(1s,2s,8s,8as)-8-hydroxy-7-{(2s)-1-[(2r)-2-(methoxymethyl)-1-pyrrolidinyl]-1-oxo-2-propanyl}-1,4a-dimethyldecahydro-2-naphthalenyl]-5-pyrimidinecarboxamide
C26H40N4O4 (472.30494000000004)
N-[[(2S,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-8-[(E)-prop-1-enyl]-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-N-methyl-3-piperidin-1-ylpropanamide
C26H40N4O4 (472.30494000000004)
(1aR)-1,1aalpha,1bbeta,4,4abeta,7aalpha,7b,8,9,9a-Decahydro-7balpha-hydroxy-9aalpha-[(1-oxo-2,3-dimethylbutyl)oxy]-3-(acetoxymethyl)-1,1,6,8alpha-tetramethyl-5H-cyclopropa[3,4]benzo[1,2-e]azulene-5-one
[(1R,2R,6R,10S,11R,13S,15R)-8-(acetyloxymethyl)-1-hydroxy-4,12,12,15-tetramethyl-5-oxo-13-tetracyclo[8.5.0.02,6.011,13]pentadeca-3,8-dienyl] 2,3-dimethylbutanoate
(1-butanoyloxy-3-hydroxypropan-2-yl) (4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoate
[(1R,2S,4S,5S,6R,7S,8R,9S,12S,13S,16S,18S)-5,7,9,13-tetramethyl-10-oxospiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2-oxane]-16-yl] acetate
[2-[(E)-dec-4-enoyl]oxy-3-hydroxypropyl] (5E,7E,9E,11E,13E)-hexadeca-5,7,9,11,13-pentaenoate
[2-[(4E,7E)-deca-4,7-dienoyl]oxy-3-hydroxypropyl] (7E,9E,11E,13E)-hexadeca-7,9,11,13-tetraenoate
Tobramycin(5+)
An organic cation obtained by protonation of the five amino groups of tobramycin.
(17alpha,23S)-Epoxy-28,29-dihydroxy-27-norlanost-8-ene-3,24-dione
(1s,3'r,3'as,7's,7'ar)-3-acetyl-3',4,7'-trihydroxy-3',7'-dimethyl-5,5-bis(3-methylbut-2-en-1-yl)-1',2',3'a,4',6',7'a-hexahydrospiro[cyclohexane-1,5'-inden]-3-ene-2,6-dione
(1s,2r,7s,9r,11s,12s,15r,16s)-15-hydroxy-15-[(1r,4r,5r,7s)-4-hydroxy-4,5-dimethyl-3-oxo-2-oxabicyclo[3.2.1]octan-7-yl]-2,16-dimethyl-8-oxapentacyclo[9.7.0.0²,⁷.0⁷,⁹.0¹²,¹⁶]octadecan-3-one
(4r)-4-[(1s,3r,6r,7r,12s,13s)-12-(3-methoxy-3-oxopropyl)-3,7-dimethyl-9-oxo-13-(prop-1-en-2-yl)-15-oxatetracyclo[10.2.1.0²,¹⁰.0³,⁷]pentadec-2(10)-en-6-yl]pentanoic acid
3-{[(3r,3ar,5as,6r,7r,9as,9br)-3-(dimethoxymethyl)-3,3a,6,7,9a-pentamethyl-octahydro-1h-cyclopenta[a]naphthalen-6-yl]methyl}-4-hydroxybenzoic acid
(8ar)-3-[(14-methylpentadecyl)oxy]-5-propyl-1h,8h,8ah-3λ⁵-furo[3,4-e][1,3,2]dioxaphosphepine-3,6-dione
2,4,6-trihydroxy-5-{1-[5-(2-hydroxypropan-2-yl)-2,8-dimethyl-4,4a,5,6,7,8-hexahydro-3h-naphthalen-2-yl]-3-methylbutyl}benzene-1,3-dicarbaldehyde
13-(acetyloxy)-1,4,8,8,11,15-hexamethyl-12-oxo-3-oxatetracyclo[11.3.0.0²,⁴.0⁷,⁹]hexadec-10-en-16-yl 2-methylbut-2-enoate
(1r,2r,6s,10s,11r,13s,15r)-8-[(acetyloxy)methyl]-1-hydroxy-4,12,12,15-tetramethyl-5-oxotetracyclo[8.5.0.0²,⁶.0¹¹,¹³]pentadeca-3,8-dien-13-yl (2r)-2,3-dimethylbutanoate
(4e)-6-(2,5-dimethoxy-3-methylphenyl)-1-[(1s,2s)-2-(4-hydroxy-4-methylpentanoyl)-1,2-dimethylcyclopentyl]-4-methylhex-4-en-2-one
(3e,7e,11e)-13-(2,5-dimethoxy-3-methylphenyl)-1-(3,3-dimethyloxiran-2-yl)-3,7,11-trimethyltrideca-3,7,11-triene-2,9-diol
(1r,4s,5r,8r,9s,11r,13s,14s,17r,18s,21s,24r)-9,21-dihydroxy-5,8,11,14,17,24-hexamethyl-22-oxahexacyclo[19.2.1.0¹,¹⁸.0⁴,¹⁷.0⁵,¹⁴.0⁸,¹³]tetracosane-10,23-dione
3-(3,4-dimethoxyphenyl)prop-2-en-1-yl 18-hydroxyoctadeca-9,12-dienoate
5-[(1s)-1-[(1r,4ar,6s,8ar)-6-(2-hydroxypropan-2-yl)-8a-methyl-4-methylidene-octahydronaphthalen-1-yl]-3-methylbutyl]-2,4,6-trihydroxybenzene-1,3-dicarbaldehyde
6-(2,5-dimethoxy-3-methylphenyl)-1-[2-(4-hydroxy-4-methylpentanoyl)-1,2-dimethylcyclopentyl]-4-methylhex-4-en-2-one
(1s,2s,7s,9r,11s,12s,15s,16s)-15-[(1r)-1-[(2r)-4,5-dimethyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-15-hydroxy-2-(hydroxymethyl)-16-methyl-8-oxapentacyclo[9.7.0.0²,⁷.0⁷,⁹.0¹²,¹⁶]octadecan-3-one
(6s)-6-[(1r)-1-[(1r,3as,3bs,5r,5ar,9ar,9bs,11as)-5,5a-dihydroxy-9a,11a-dimethyl-9-oxo-1h,2h,3h,3ah,3bh,4h,5h,6h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl]ethyl]-3-(hydroxymethyl)-4-methyl-5,6-dihydropyran-2-one
2-acetyl-12-(acetyloxy)-7-ethyl-4b,7,10a,12a-tetramethyl-1,4,4a,5,6,6a,8,9,10,10b,11,12-dodecahydrochrysene-1-carboxylic acid
(1r,5s,8r,9r,12r,19r)-19-ethoxy-5,9,17,17-tetramethyl-8-[(2r)-4-oxopentan-2-yl]-18-oxapentacyclo[10.5.2.0¹,¹³.0⁴,¹².0⁵,⁹]nonadecane-3,16-dione
6,6-bis(hydroxymethyl)-3',3a,9a,11a-tetramethyl-5'-propanoyl-3,4,5,5a,8,9,10,11-octahydro-2h-spiro[cyclopenta[a]phenanthrene-1,2'-oxolan]-7-one
(2r,3e)-5-(3-formyl-2,6-dihydroxy-4-methylphenyl)-3-methyl-1-[(1s,2r,6r)-1,2,6-trimethyl-3-oxocyclohexyl]pent-3-en-2-yl 3-methylbutanoate
(3s,5br,8r,9r,11ar,13s,13as)-8-ethyl-13-hydroxy-3,5b,8,11a,13a-pentamethyl-1-oxo-3h,4h,5h,5ah,6h,7h,7ah,9h,10h,11h,11bh,12h,13h-chryseno[1,2-c]furan-9-yl acetate
2-[15-(2h-1,3-benzodioxol-5-yl)pentadecanoyl]-3,4-dihydroxycyclohex-2-en-1-one
methyl 4-[(1r,3s,3ar,9as,11ar)-3-hydroxy-3a,6,6,9a,11a-pentamethyl-4,7,10-trioxo-1h,2h,3h,5h,5ah,8h,9h,11h-cyclopenta[a]phenanthren-1-yl]pentanoate
1,10,11-trihydroxy-1,2,6a,6b,12a-pentamethyl-9-methylidene-2,3,4,5,6,7,8,8a,10,11,12,12b,13,14b-tetradecahydropicene-4a-carboxylic acid
5,10,11-trihydroxy-2,2,6a,6b,12a-pentamethyl-9-methylidene-1,3,4,5,6,7,8,8a,10,11,12,12b,13,14b-tetradecahydropicene-4a-carboxylic acid
9-hydroxy-9a-methoxy-4a,5-dimethyl-3-methylidene-octahydro-2h-naphtho[2,3-b]furan-6-yl 5-methyldodeca-2,4,6-trienoate
(1e,6e,13e)-3,15-dihydroxy-1-(5-hydroxy-2-methoxy-3-methylphenyl)-3,7,11,15-tetramethylhexadeca-1,6,13-triene-5,12-dione
(3e,6r,10e,12r,14e)-16-(2,5-dimethoxy-3-methylphenyl)-2,12-dihydroxy-2,6,10,14-tetramethylhexadeca-3,10,14-trien-5-one
(2r,5r)-5-[(4e,8e)-10-(5-hydroxy-2-methoxy-3-methylphenyl)-4,8-dimethyl-6-oxodeca-4,8-dien-1-yl]-2-(2-hydroxypropan-2-yl)-5-methyloxolan-3-one
(2r,4ar,10ar,12ar)-2-(2-hydroxypropan-2-yl)-4a,10a-dimethyl-8-[(2s,4s)-4-methyl-3-oxohexan-2-yl]-2,3,4,4b,5,11,12,12a-octahydro-1,10-dioxatetraphene-6,9-dione
2-[15-(2h-1,3-benzodioxol-5-yl)pentadecanoyl]-3,6-dihydroxycyclohex-2-en-1-one
24,25-dihydrowithanolide a
{"Ingredient_id": "HBIN004192","Ingredient_name": "24,25-dihydrowithanolide a","Alias": "NA","Ingredient_formula": "C28H40O6","Ingredient_Smile": "CC1CC(OC(=O)C1C)C(C)(C2CCC3C2(CCC4C3C5C(O5)C6(C4(C(=O)C=CC6)C)O)C)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5739","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
2α,3α,19α-trihydroxy-24-norurs-4(23),12-dien-28-oicacid
{"Ingredient_id": "HBIN005167","Ingredient_name": "2\u03b1,3\u03b1,19\u03b1-trihydroxy-24-norurs-4(23),12-dien-28-oicacid","Alias": "NA","Ingredient_formula": "C29H44O5","Ingredient_Smile": "CC1(CCC2(C(C1)C3=CCC4C(C3(CC2O)C)(CCC5C4(CC(C(C5=C)O)O)C)C)C(=O)O)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "21801","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
2α,3β,23-trihydroxy-30-noroleana-12,20(21)-dien-28-oicacid
{"Ingredient_id": "HBIN005207","Ingredient_name": "2\u03b1,3\u03b2,23-trihydroxy-30-noroleana-12,20(21)-dien-28-oicacid","Alias": "NA","Ingredient_formula": "C29H44O5","Ingredient_Smile": "CC12CCC3C(C1CC=C4C2(CCC5(C4CC(=C)CC5)C(=O)O)C)(CC(C(C3(C)CO)O)O)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "21796","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
2α,3β,23-trihydroxy-30-noroleana-12,20(29)-dien-28-oicacid
{"Ingredient_id": "HBIN005208","Ingredient_name": "2\u03b1,3\u03b2,23-trihydroxy-30-noroleana-12,20(29)-dien-28-oicacid","Alias": "NA","Ingredient_formula": "C29H44O5","Ingredient_Smile": "CC12CCC3C(C1CC=C4C2(CCC5(C4CC(=C)CC5)C(=O)O)C)(CC(C(C3(C)CO)O)O)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "21797","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
4,20-dideoxyphorbol 12,13-bis(isobutyrate)
{"Ingredient_id": "HBIN009849","Ingredient_name": "4,20-dideoxyphorbol 12,13-bis(isobutyrate)","Alias": "NA","Ingredient_formula": "C28H40O6","Ingredient_Smile": "CC1C(C2(C(C2(C)C)C3C1(C4C=C(C(=O)C4CC(=C3)C)C)O)OC(=O)C(C)C)OC(=O)C(C)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5475","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
4β,7β,20r-trihydroxy-1-oxowitha-2,5-dien-22,26-olide
{"Ingredient_id": "HBIN010259","Ingredient_name": "4\u03b2,7\u03b2,20r-trihydroxy-1-oxowitha-2,5-dien-22,26-olide","Alias": "NA","Ingredient_formula": "C28H40O6","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "21818","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
ajugin f
{"Ingredient_id": "HBIN014989","Ingredient_name": "ajugin f","Alias": "NA","Ingredient_formula": "C28H40O6","Ingredient_Smile": "CC1=C(C(=O)OC(C1)C(C)C2(CCC3(C2(CCC4C3CC=C5C4(C(=O)CCC5)C)C)O)O)CO","Ingredient_weight": "472.6 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "814","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "101010479","DrugBank_id": "NA"}
anticancer withanolide pmv70p691-049
{"Ingredient_id": "HBIN016371","Ingredient_name": "anticancer withanolide pmv70p691-049","Alias": "NA","Ingredient_formula": "C28H40O6","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "1455","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}