Exact Mass: 560.3352116
Exact Mass Matches: 560.3352116
Found 500 metabolites which its exact mass value is equals to given mass value 560.3352116
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Dihydrocucurbitacin B
23,24-dihydrocucurbitacin B is a 23,24-dihydrocucurbitacin in which a lanostane skeleton is multi-substituted with hydroxy, methyl and oxo substituents, with unsaturation at position 5; a hydroxy function at C-25 is acetylated. It is a 23,24-dihydrocucurbitacin, a secondary alpha-hydroxy ketone and a tertiary alpha-hydroxy ketone. It is functionally related to a cucurbitacin B. Dihydrocucurbitacin B is a natural product found in Bryonia alba, Citrullus colocynthis, and other organisms with data available. Dihydrocucurbitacin B, a triterpene isolated from Cayaponia tayuya roots, inhibits nuclear factor of activated T cells (NFAT), induces cell cycle arrested in the G0 phase, and inhibits delayed type hypersensitivity[1]. Dihydrocucurbitacin B, a triterpene isolated from Cayaponia tayuya roots, inhibits nuclear factor of activated T cells (NFAT), induces cell cycle arrested in the G0 phase, and inhibits delayed type hypersensitivity[1].
Deferoxamine
Deferoxamine is only found in individuals that have used or taken this drug. It is a natural product isolated from Streptomyces pilosus. It forms iron complexes and is used as a chelating agent, particularly in the mesylate form. [PubChem]Deferoxamine works in treating iron toxicity by binding trivalent (ferric) iron (for which it has a strong affinity), forming ferrioxamine, a stable complex which is eliminated via the kidneys. 100 mg of deferoxamine is capable of binding approximately 8.5 mg of trivalent (ferric) iron. Deferoxamine works in treating aluminum toxicity by binding to tissue-bound aluminum to form aluminoxamine, a stable, water-soluble complex. The formation of aluminoxamine increases blood concentrations of aluminum, resulting in an increased concentration gradient between the blood and dialysate, boosting the removal of aluminum during dialysis. 100 mg of deferoxamine is capable of binding approximately 4.1 mg of aluminum. V - Various > V03 - All other therapeutic products > V03A - All other therapeutic products > V03AC - Iron chelating agents D064449 - Sequestering Agents > D002614 - Chelating Agents > D007502 - Iron Chelating Agents COVID info from clinicaltrial, clinicaltrials, clinical trial, clinical trials Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS Deferoxamine (Deferoxamine B) is an iron chelator (binds to Fe(III) and many other metal cations), is widely used to reduce iron accumulation and deposition in tissues. Deferoxamine upregulates HIF-1α levels with good antioxidant activity. Deferoxamine also shows anti-proliferative activity, can induce apoptosis and autophagy in cancer cells. Deferoxamine can be used in studies of diabetes, neurodegenerative diseases as well as anti-cancer and anti-COVID-19[1][2][3][4][5].
Cucurbitacin C
Cucurbitacin C is found in cucumber. Cucurbitacin C is a constituent of Cucurbitaceae, e.g. Cucumis sativus (cucumber) Constituent of Cucurbitaceae, e.g. Cucumis sativus (cucumber). Cucurbitacin C is found in cucumber and fruits.
Vitamin D3 glucosiduronate
DG(8:0/22:6(5Z,8E,10Z,13Z,15E,19Z)-2OH(7S, 17S)/0:0)
DG(8:0/22:6(5Z,8E,10Z,13Z,15E,19Z)-2OH(7S, 17S)/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(8:0/22:6(5Z,8E,10Z,13Z,15E,19Z)-2OH(7S, 17S)/0:0) is also a substrate of diacylglycerol kinase. It is involved in the phospholipid metabolic pathway.
DG(22:6(5Z,8E,10Z,13Z,15E,19Z)-2OH(7S, 17S)/8:0/0:0)
DG(22:6(5Z,8E,10Z,13Z,15E,19Z)-2OH(7S, 17S)/8:0/0:0) 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(22:6(5Z,8E,10Z,13Z,15E,19Z)-2OH(7S, 17S)/8:0/0:0) is also a substrate of diacylglycerol kinase. It is involved in the phospholipid metabolic pathway.
DG(8:0/0:0/22:6(5Z,8E,10Z,13Z,15E,19Z)-2OH(7S, 17S))
DG(8:0/0:0/22:6(5Z,8E,10Z,13Z,15E,19Z)-2OH(7S, 17S)) 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(22:6(5Z,8E,10Z,13Z,15E,19Z)-2OH(7S, 17S)/0:0/8:0)
DG(22:6(5Z,8E,10Z,13Z,15E,19Z)-2OH(7S, 17S)/0:0/8:0) 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.
DG(8:0/22:6(4Z,7Z,11E,13Z,15E,19Z)-2OH(10S,17)/0:0)
DG(8:0/22:6(4Z,7Z,11E,13Z,15E,19Z)-2OH(10S,17)/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(8:0/22:6(4Z,7Z,11E,13Z,15E,19Z)-2OH(10S,17)/0:0) is also a substrate of diacylglycerol kinase. It is involved in the phospholipid metabolic pathway.
DG(22:6(4Z,7Z,11E,13Z,15E,19Z)-2OH(10S,17)/8:0/0:0)
DG(22:6(4Z,7Z,11E,13Z,15E,19Z)-2OH(10S,17)/8:0/0:0) 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(22:6(4Z,7Z,11E,13Z,15E,19Z)-2OH(10S,17)/8:0/0:0) is also a substrate of diacylglycerol kinase. It is involved in the phospholipid metabolic pathway.
DG(8:0/0:0/22:6(4Z,7Z,11E,13Z,15E,19Z)-2OH(10S,17))
DG(8:0/0:0/22:6(4Z,7Z,11E,13Z,15E,19Z)-2OH(10S,17)) 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(22:6(4Z,7Z,11E,13Z,15E,19Z)-2OH(10S,17)/0:0/8:0)
DG(22:6(4Z,7Z,11E,13Z,15E,19Z)-2OH(10S,17)/0:0/8:0) 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.
Oleoyl danshenxinkun A
A diterpenoid with a fatty acyl side chain isolated from Salvia miltiorrhiza and has been shown to inhibit platelet aggregation induced by arachidonic acid.
2, 16, 18-Tri-Ac-(1alpha, 3beta, 11alpha)-Cholest-5-ene-2, 3, 16, 18-tetrol, 9CI
Ecdysterone 2,3:20,22-diacetonide
Origin: Plant; SubCategory_DNP: The sterols, Cholestanes
12-O-decanoylphorbol-13-acetate|12-O-n-Decanoyl-phorbol-(13)-acetat|Cocarcinogen A2|Phorbol-12-caprate-13-acetate
7, 15, 18-Tri-Ac-(3alpha, 7beta, 15beta)-Cholest-5-ene-3, 7, 15, 18-tetrol, 9CI
12-O-Acetyl-phorbol-(13)-n-decanoat|12-O-acetylphorbol 13-decanoate|Cocarcinogen B7|N-6
(-)-6-dehydroxy-O10-buxafuranamine|6-Dehyroxy-O10-buxafuranamine
6beta-hydroxyzuelanin-2alpha-n-octanoate|6beta-hydroxyzuelanin-2beta-n-octanoate
12alpha-acetoxy-16beta-(3-hydroxybutanoyloxy)-13beta,18beta-cyclobutan-20,24-dimethyl-24-oxoscalaran-25-ol
2,3-dihydro-3-methoxy-16alpha-hydroxywithacnistine
19alpha,22alpha-dihydroxy-24-nor-2,3-seco-urs-12-ene-2,3,28-trioic acid trimethyl ester
(E)-3beta-hydroxy-15beta-O-(beta-D-xylopyranosyl)-ergosta-5,22-dien-16-one|acanthifolioside A
neoruscogenin 1-O-alpha-L-arabinopyranoside|spirosta-5,25(27)-dien-1beta,3beta-diol 1-O-alpha-L-arabinopyranoside
spirost-5,25(27)-diene-1,3-diol 1-O-alpha-L-arabinopyranoside
14-hydroxy-3beta-(O3-methyl-6-deoxy-alpha-L-glucopyranosyloxy)-19-oxo-5alpha,14beta-bufa-20,22-dienolide|14-Hydroxy-3beta-(O3-methyl-6-desoxy-alpha-L-glucopyranosyloxy)-19-oxo-5alpha,14beta-bufa-20,22-dienolid
16-O-acetyl-cucurbitacin F|2beta,3alpha,20,25-tetrahydroxycucurbita-5,23(E)-diene-11,22-dione-16-acetate
7alpha-acetoxy-21R?,23R?-epoxy-24S?,25-dihydroxy-21alpha-methoxy-4,4,8-trimethyl-cholesta-14-en-3-one|7alpha-acetoxy-21S?,23R?-epoxy-24S?,25-dihydroxy-21beta-methoxy-4,4,8-trimethyl-cholesta-14-en-3-one|brujavanone I|brujavanone J
24-epi-pterosterone 2,3:20,22-diacetonide|24-epipterosterone-2,3,20,22-diacetonide
7alpha-acetoxy-21S?,23R?-epoxy-11alpha,21beta,24S?,25-tetrahydroxy-4,4,8-trimethyl-cholesta-1,14-dien-3-one|brujavanone E
3??-Oxo-formyl-7??,12??-dihydroxy-5??-lanost-11,15,23-trioxo-8-en(E)-26-0ic acid
ajugasterone C 2,3;20,22-diacetonide|ajugasterone C-2,3,20,22-diacetonide
3-epi-gomphoside 3-acetate|3-O-acetyl-3-epigomphoside
12alpha-acetoxy-16beta-(3R-hydroxybutanoyloxy)-20,24-dimethyl-24-oxoscalaran-25-al
rel-18(S),19(R)-diacetoxy-18,19-epoxy-6(R)-hydroxy-2(S)-octanoyloxy-5(R),8(S),9(S),10(R)-cleroda-3,13(16),14-triene
14-hydroxyplagiochiline-A-15-yl 2E,4E-dodecadienoate
3-[rel-(2R,3R)-4-hydroxy-6-(3alpha-isopropenyl-2,2-dimethylcyclobutyl-beta-methyl)-2,3-dimethyl-6-(3-methylbut-2-enyl)-5,7-dioxo-3,5,6,7-tetrahydro-2H-chromen-8-yl]-3-phenylpropionic acid|brasiliensophyllic acid A
3alpha,22alpha-diacetoxy-20beta,21alpha,29-trihydrohy-30-norolean-12-ene
Cucurbitacin Q1
Cucurbitacin Q1 is a natural product found in Elaeocarpus chinensis and Hemsleya ellipsoidea with data available.
deferoxamine
V - Various > V03 - All other therapeutic products > V03A - All other therapeutic products > V03AC - Iron chelating agents D064449 - Sequestering Agents > D002614 - Chelating Agents > D007502 - Iron Chelating Agents COVID info from clinicaltrial, clinicaltrials, clinical trial, clinical trials Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS Deferoxamine (Deferoxamine B) is an iron chelator (binds to Fe(III) and many other metal cations), is widely used to reduce iron accumulation and deposition in tissues. Deferoxamine upregulates HIF-1α levels with good antioxidant activity. Deferoxamine also shows anti-proliferative activity, can induce apoptosis and autophagy in cancer cells. Deferoxamine can be used in studies of diabetes, neurodegenerative diseases as well as anti-cancer and anti-COVID-19[1][2][3][4][5].
N-[5-[[4-[5-[acetyl(hydroxy)amino]pentylamino]-4-oxobutanoyl]-hydroxyamino]pentyl]-N-(5-aminopentyl)-N-hydroxybutanediamide
C32H48O8_Propanedioic acid, mono[12-(acetyloxy)-4,4,8,10,14-pentamethyl-17-(tetrahydro-2-methyl-5-oxo-2-furanyl)gonan-3-yl] ester
Desferrioxamine b
An acyclic desferrioxamine that is butanedioic acid in which one of the carboxy groups undergoes formal condensation with the primary amino group of N-(5-aminopentyl)-N-hydroxyacetamide and the second carboxy group undergoes formal condensation with the hydroxyamino group of N(1)-(5-aminopentyl)-N(1)-hydroxy-N(4)-[5-(hydroxyamino)pentyl]butanediamide. It is a siderophore native to Streptomyces pilosus biosynthesised by the DesABCD enzyme cluster as a high affinity Fe(III) chelator.
Asp Ile Lys Trp
Asp Ile Trp Lys
Asp Lys Ile Trp
Asp Lys Leu Trp
Asp Lys Trp Ile
Asp Lys Trp Leu
Asp Leu Lys Trp
Asp Leu Trp Lys
Asp Trp Ile Lys
Asp Trp Lys Ile
Asp Trp Lys Leu
Asp Trp Leu Lys
Glu Lys Val Trp
Glu Lys Trp Val
Glu Arg Arg Thr
C21H40N10O8 (560.3030440000001)
Glu Arg Thr Arg
C21H40N10O8 (560.3030440000001)
Glu Thr Arg Arg
C21H40N10O8 (560.3030440000001)
Glu Val Lys Trp
Glu Val Trp Lys
Glu Trp Lys Val
Glu Trp Val Lys
Ile Asp Lys Trp
Ile Asp Trp Lys
Ile Lys Asp Trp
Ile Lys Trp Asp
Ile Arg Ser Trp
C26H40N8O6 (560.3070660000001)
Ile Arg Trp Ser
C26H40N8O6 (560.3070660000001)
Ile Ser Arg Trp
C26H40N8O6 (560.3070660000001)
Ile Ser Trp Arg
C26H40N8O6 (560.3070660000001)
Ile Trp Asp Lys
Ile Trp Lys Asp
Ile Trp Arg Ser
C26H40N8O6 (560.3070660000001)
Ile Trp Ser Arg
C26H40N8O6 (560.3070660000001)
Lys Asp Ile Trp
Lys Asp Leu Trp
Lys Asp Trp Ile
Lys Asp Trp Leu
Lys Glu Val Trp
Lys Glu Trp Val
Lys Ile Asp Trp
Lys Ile Trp Asp
Lys Leu Asp Trp
Lys Leu Trp Asp
Lys Val Glu Trp
Lys Val Trp Glu
Lys Trp Asp Ile
Lys Trp Asp Leu
Lys Trp Glu Val
Lys Trp Ile Asp
Lys Trp Leu Asp
Lys Trp Val Glu
Leu Asp Lys Trp
Leu Asp Trp Lys
Leu Lys Asp Trp
Leu Lys Trp Asp
Leu Arg Ser Trp
C26H40N8O6 (560.3070660000001)
Leu Arg Trp Ser
C26H40N8O6 (560.3070660000001)
Leu Ser Arg Trp
C26H40N8O6 (560.3070660000001)
Leu Ser Trp Arg
C26H40N8O6 (560.3070660000001)
Leu Trp Asp Lys
Leu Trp Lys Asp
Leu Trp Arg Ser
C26H40N8O6 (560.3070660000001)
Leu Trp Ser Arg
C26H40N8O6 (560.3070660000001)
Met Arg Arg Val
Met Arg Val Arg
Met Val Arg Arg
Arg Glu Arg Thr
C21H40N10O8 (560.3030440000001)
Arg Glu Thr Arg
C21H40N10O8 (560.3030440000001)
Arg Ile Ser Trp
C26H40N8O6 (560.3070660000001)
Arg Ile Trp Ser
C26H40N8O6 (560.3070660000001)
Arg Leu Ser Trp
C26H40N8O6 (560.3070660000001)
Arg Leu Trp Ser
C26H40N8O6 (560.3070660000001)
Arg Met Arg Val
Arg Met Val Arg
Arg Arg Glu Thr
C21H40N10O8 (560.3030440000001)
Arg Arg Met Val
Arg Arg Thr Glu
C21H40N10O8 (560.3030440000001)
Arg Arg Val Met
Arg Ser Ile Trp
C26H40N8O6 (560.3070660000001)
Arg Ser Leu Trp
C26H40N8O6 (560.3070660000001)
Arg Ser Trp Ile
C26H40N8O6 (560.3070660000001)
Arg Ser Trp Leu
C26H40N8O6 (560.3070660000001)
Arg Thr Glu Arg
C21H40N10O8 (560.3030440000001)
Arg Thr Arg Glu
C21H40N10O8 (560.3030440000001)
Arg Thr Val Trp
C26H40N8O6 (560.3070660000001)
Arg Thr Trp Val
C26H40N8O6 (560.3070660000001)
Arg Val Met Arg
Arg Val Arg Met
Arg Val Thr Trp
C26H40N8O6 (560.3070660000001)
Arg Val Trp Thr
C26H40N8O6 (560.3070660000001)
Arg Trp Ile Ser
C26H40N8O6 (560.3070660000001)
Arg Trp Leu Ser
C26H40N8O6 (560.3070660000001)
Arg Trp Ser Ile
C26H40N8O6 (560.3070660000001)
Arg Trp Ser Leu
C26H40N8O6 (560.3070660000001)
Arg Trp Thr Val
C26H40N8O6 (560.3070660000001)
Arg Trp Val Thr
C26H40N8O6 (560.3070660000001)
Ser Ile Arg Trp
C26H40N8O6 (560.3070660000001)
Ser Ile Trp Arg
C26H40N8O6 (560.3070660000001)
Ser Leu Arg Trp
C26H40N8O6 (560.3070660000001)
Ser Leu Trp Arg
C26H40N8O6 (560.3070660000001)
Ser Arg Ile Trp
C26H40N8O6 (560.3070660000001)
Ser Arg Leu Trp
C26H40N8O6 (560.3070660000001)
Ser Arg Trp Ile
C26H40N8O6 (560.3070660000001)
Ser Arg Trp Leu
C26H40N8O6 (560.3070660000001)
Ser Trp Ile Arg
C26H40N8O6 (560.3070660000001)
Ser Trp Leu Arg
C26H40N8O6 (560.3070660000001)
Ser Trp Arg Ile
C26H40N8O6 (560.3070660000001)
Ser Trp Arg Leu
C26H40N8O6 (560.3070660000001)
Thr Glu Arg Arg
C21H40N10O8 (560.3030440000001)
Thr Arg Glu Arg
C21H40N10O8 (560.3030440000001)
Thr Arg Arg Glu
C21H40N10O8 (560.3030440000001)
Thr Arg Val Trp
C26H40N8O6 (560.3070660000001)
Thr Arg Trp Val
C26H40N8O6 (560.3070660000001)
Thr Val Arg Trp
C26H40N8O6 (560.3070660000001)
Thr Val Trp Arg
C26H40N8O6 (560.3070660000001)
Thr Trp Arg Val
C26H40N8O6 (560.3070660000001)
Thr Trp Val Arg
C26H40N8O6 (560.3070660000001)
Val Glu Lys Trp
Val Glu Trp Lys
Val Lys Glu Trp
Val Lys Trp Glu
Val Met Arg Arg
Val Arg Met Arg
Val Arg Arg Met
Val Arg Thr Trp
C26H40N8O6 (560.3070660000001)
Val Arg Trp Thr
C26H40N8O6 (560.3070660000001)
Val Thr Arg Trp
C26H40N8O6 (560.3070660000001)
Val Thr Trp Arg
C26H40N8O6 (560.3070660000001)
Val Trp Glu Lys
Val Trp Lys Glu
Val Trp Arg Thr
C26H40N8O6 (560.3070660000001)
Val Trp Thr Arg
C26H40N8O6 (560.3070660000001)
Trp Asp Ile Lys
Trp Asp Lys Ile
Trp Asp Lys Leu
Trp Asp Leu Lys
Trp Glu Lys Val
Trp Glu Val Lys
Trp Ile Asp Lys
Trp Ile Lys Asp
Trp Ile Arg Ser
C26H40N8O6 (560.3070660000001)
Trp Ile Ser Arg
C26H40N8O6 (560.3070660000001)
Trp Lys Asp Ile
Trp Lys Asp Leu
Trp Lys Glu Val
Trp Lys Ile Asp
Trp Lys Leu Asp
Trp Lys Val Glu
Trp Leu Asp Lys
Trp Leu Arg Ser
C26H40N8O6 (560.3070660000001)
Trp Leu Ser Arg
C26H40N8O6 (560.3070660000001)
Trp Arg Ile Ser
C26H40N8O6 (560.3070660000001)
Trp Arg Leu Ser
C26H40N8O6 (560.3070660000001)
Trp Arg Ser Ile
C26H40N8O6 (560.3070660000001)
Trp Arg Ser Leu
C26H40N8O6 (560.3070660000001)
Trp Arg Thr Val
C26H40N8O6 (560.3070660000001)
Trp Arg Val Thr
C26H40N8O6 (560.3070660000001)
Trp Ser Ile Arg
C26H40N8O6 (560.3070660000001)
Trp Ser Leu Arg
C26H40N8O6 (560.3070660000001)
Trp Ser Arg Ile
C26H40N8O6 (560.3070660000001)
Trp Ser Arg Leu
C26H40N8O6 (560.3070660000001)
Trp Thr Arg Val
C26H40N8O6 (560.3070660000001)
Trp Thr Val Arg
C26H40N8O6 (560.3070660000001)
Trp Val Arg Thr
C26H40N8O6 (560.3070660000001)
Trp Val Thr Arg
C26H40N8O6 (560.3070660000001)
METHYL 3β,12-DIHYDROXY-11-KETOISOALLOSPIROSTAN-3-HEMISUCCINATE
cucurbitacin c
Cucurbitacin C6
4,4-Bis[(1E)-2-[4-(hexyloxy)phenyl]ethenyl]-2,2-bipyridine
TETRAETHYL 1,1-HEXAMETHYLENEBIS(2,5-DIMETHYL-1H-PYRROLE-3,4-DICARBOXYLATE)
dodecane-1-thiol,2-methylidenebutanoic acid,methyl 2-methylprop-2-enoate,2-methylprop-2-enoic acid,prop-2-enoic acid
7-Demethoxyegonol Oleate
A fatty acid ester that is egonol oleate in which the methoxy group at position 7 is replaced by a hydrogen. Isolated from the fruits of Styrax agrestis, it exhibits inhibitory activity against acetylcholinesterase.
13201-14-4
Dihydrocucurbitacin B, a triterpene isolated from Cayaponia tayuya roots, inhibits nuclear factor of activated T cells (NFAT), induces cell cycle arrested in the G0 phase, and inhibits delayed type hypersensitivity[1]. Dihydrocucurbitacin B, a triterpene isolated from Cayaponia tayuya roots, inhibits nuclear factor of activated T cells (NFAT), induces cell cycle arrested in the G0 phase, and inhibits delayed type hypersensitivity[1].
Cucurbitacin C
Cucurbitacin C is found in cucumber. Cucurbitacin C is a constituent of Cucurbitaceae, e.g. Cucumis sativus (cucumber) Constituent of Cucurbitaceae, e.g. Cucumis sativus (cucumber). Cucurbitacin C is found in cucumber and fruits.
[(6R)-6-[(2S,9R,10R,13R,14S,16R)-2,16-dihydroxy-4,4,9,13,14-pentamethyl-3,11-dioxo-2,7,8,10,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-6-hydroxy-2-methyl-5-oxoheptan-2-yl] acetate
[(2S,3R,4R,5S)-2-[(2R,4R,5S,7S,12S,16S)-4,5-dihydroxy-2,16-dimethyl-8-oxo-9-oxatetracyclo[9.7.0.02,7.012,16]octadecan-15-yl]-4-hydroxy-5,6-dimethylheptan-3-yl] hydrogen sulfate
Cholcalciferyl-β-D-glucopyranosid-uronsaeure
DG(8:0/22:6(5Z,8E,10Z,13Z,15E,19Z)-2OH(7S, 17S)/0:0)
DG(22:6(5Z,8E,10Z,13Z,15E,19Z)-2OH(7S, 17S)/8:0/0:0)
DG(8:0/0:0/22:6(5Z,8E,10Z,13Z,15E,19Z)-2OH(7S, 17S))
DG(22:6(5Z,8E,10Z,13Z,15E,19Z)-2OH(7S, 17S)/0:0/8:0)
DG(8:0/22:6(4Z,7Z,11E,13Z,15E,19Z)-2OH(10S,17)/0:0)
DG(22:6(4Z,7Z,11E,13Z,15E,19Z)-2OH(10S,17)/8:0/0:0)
DG(8:0/0:0/22:6(4Z,7Z,11E,13Z,15E,19Z)-2OH(10S,17))
DG(22:6(4Z,7Z,11E,13Z,15E,19Z)-2OH(10S,17)/0:0/8:0)
12-o-Decanoylphorbol-13-acetate
A natural product found in Pimelea elongata and Croton tiglium.
3-cyclohexyl-1-[[(10R,11S)-13-[(2R)-1-hydroxypropan-2-yl]-11,16-dimethyl-14-oxo-9-oxa-13,16-diazatetracyclo[13.7.0.02,7.017,22]docosa-1(15),2,4,6,17,19,21-heptaen-10-yl]methyl]-1-methylurea
3-cyclohexyl-1-[[(10S,11R)-13-[(2S)-1-hydroxypropan-2-yl]-11,16-dimethyl-14-oxo-9-oxa-13,16-diazatetracyclo[13.7.0.02,7.017,22]docosa-1(15),2,4,6,17,19,21-heptaen-10-yl]methyl]-1-methylurea
3-cyclohexyl-1-[[(10S,11S)-13-[(2R)-1-hydroxypropan-2-yl]-11,16-dimethyl-14-oxo-9-oxa-13,16-diazatetracyclo[13.7.0.02,7.017,22]docosa-1(15),2,4,6,17,19,21-heptaen-10-yl]methyl]-1-methylurea
3-cyclohexyl-1-[[(10R,11S)-13-[(2S)-1-hydroxypropan-2-yl]-11,16-dimethyl-14-oxo-9-oxa-13,16-diazatetracyclo[13.7.0.02,7.017,22]docosa-1(15),2,4,6,17,19,21-heptaen-10-yl]methyl]-1-methylurea
3-cyclohexyl-1-[[(10S,11R)-13-[(2R)-1-hydroxypropan-2-yl]-11,16-dimethyl-14-oxo-9-oxa-13,16-diazatetracyclo[13.7.0.02,7.017,22]docosa-1(15),2,4,6,17,19,21-heptaen-10-yl]methyl]-1-methylurea
3-cyclohexyl-1-[[(10S,11S)-13-[(2S)-1-hydroxypropan-2-yl]-11,16-dimethyl-14-oxo-9-oxa-13,16-diazatetracyclo[13.7.0.02,7.017,22]docosa-1(15),2,4,6,17,19,21-heptaen-10-yl]methyl]-1-methylurea
3-cyclohexyl-1-[[(10R,11R)-13-[(2S)-1-hydroxypropan-2-yl]-11,16-dimethyl-14-oxo-9-oxa-13,16-diazatetracyclo[13.7.0.02,7.017,22]docosa-1(15),2,4,6,17,19,21-heptaen-10-yl]methyl]-1-methylurea
2-[hydroxy-[(2R)-3-hydroxy-2-[(5Z,8Z,11R,12E,14Z)-11-hydroxyicosa-5,8,12,14-tetraenoyl]oxypropoxy]phosphoryl]oxyethyl-trimethylazanium
2-[hydroxy-[(2R)-3-hydroxy-2-[(5Z,8Z,11Z,13E,15R)-15-hydroxyicosa-5,8,11,13-tetraenoyl]oxypropoxy]phosphoryl]oxyethyl-trimethylazanium
2-[hydroxy-[(2R)-3-hydroxy-2-[(5Z,8Z,11Z,13E,15S)-15-hydroxyicosa-5,8,11,13-tetraenoyl]oxypropoxy]phosphoryl]oxyethyl-trimethylazanium
(1R,6S,7S,8R,12S,16R,18R)-6,7-dihydroxy-8-(hydroxymethyl)-4,18-dimethyl-16-prop-1-en-2-yl-14-undecyl-9,13,15,19-tetraoxahexacyclo[12.4.1.01,11.02,6.08,10.012,16]nonadec-3-en-5-one
(5alpha,8xi,9xi,14xi,17xi)-3-[(6-deoxy-3-O-methylhexopyranosyl)oxy]-14-hydroxy-19-oxobufa-20,22-dienolide
[1-acetyloxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-2-yl] (Z)-octadec-9-enoate
[1-butanoyloxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-2-yl] (Z)-hexadec-9-enoate
[1-propanoyloxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-2-yl] (Z)-heptadec-9-enoate
[1-hexanoyloxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-2-yl] (Z)-tetradec-9-enoate
[1-heptanoyloxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-2-yl] (Z)-tridec-9-enoate
[1-pentanoyloxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-2-yl] (Z)-pentadec-9-enoate
(1-nonanoyloxy-3-phosphonooxypropan-2-yl) (9Z,12Z)-heptadeca-9,12-dienoate
(1-heptanoyloxy-3-phosphonooxypropan-2-yl) (9Z,12Z)-nonadeca-9,12-dienoate
(1-pentanoyloxy-3-phosphonooxypropan-2-yl) (11Z,14Z)-henicosa-11,14-dienoate
(1-octanoyloxy-3-phosphonooxypropan-2-yl) (9Z,12Z)-octadeca-9,12-dienoate
(1-hexanoyloxy-3-phosphonooxypropan-2-yl) (11Z,14Z)-icosa-11,14-dienoate
(1-butanoyloxy-3-phosphonooxypropan-2-yl) (13Z,16Z)-docosa-13,16-dienoate
(1-acetyloxy-3-phosphonooxypropan-2-yl) (13Z,16Z)-tetracosa-13,16-dienoate
(1-decanoyloxy-3-phosphonooxypropan-2-yl) (9Z,12Z)-hexadeca-9,12-dienoate
[3-phosphonooxy-2-[(Z)-tridec-9-enoyl]oxypropyl] (Z)-tridec-9-enoate
(1R,2R,6S,7S,8R,12S,16R,18R)-6,7-dihydroxy-8-(hydroxymethyl)-4,18-dimethyl-16-prop-1-en-2-yl-14-undecyl-9,13,15,19-tetraoxahexacyclo[12.4.1.01,11.02,6.08,10.012,16]nonadec-3-en-5-one
(1-decanoyloxy-3-phosphonooxypropan-2-yl) (4E,7E)-hexadeca-4,7-dienoate
2-[[3-acetyloxy-2-[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyl]oxypropoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium
2-[hydroxy-[3-[(9Z,12Z,15Z)-octadeca-9,12,15-trienoxy]-2-propanoyloxypropoxy]phosphoryl]oxyethyl-trimethylazanium
2-[[3-butanoyloxy-2-[(7Z,10Z,13Z)-hexadeca-7,10,13-trienoyl]oxypropoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium
2-[[3-[(7Z,10Z,13Z)-hexadeca-7,10,13-trienoxy]-2-pentanoyloxypropoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium
23,24-dihydrocucurbitacin B
A 23,24-dihydrocucurbitacin in which a lanostane skeleton is multi-substituted with hydroxy, methyl and oxo substituents, with unsaturation at position 5; a hydroxy function at C-25 is acetylated.
methyl 6-{3,11-dihydroxy-3a,6,6,9a,11a-pentamethyl-4,7,10-trioxo-1h,2h,3h,5h,5ah,8h,9h,11h-cyclopenta[a]phenanthren-1-yl}-6-hydroxy-2-methyl-4-oxoheptanoate
3-[(2r,3r)-5-hydroxy-2,3-dimethyl-8-[5-methyl-2-(prop-1-en-2-yl)hex-4-en-1-yl]-8-(3-methylbut-2-en-1-yl)-4,7-dioxo-2,3-dihydro-1-benzopyran-6-yl]-3-phenylpropanoic acid
(6r)-6-[(1r,2r,3as,3bs,7s,9ar,9br,11ar)-2,7-dihydroxy-3a,6,6,9b,11a-pentamethyl-8,10-dioxo-1h,2h,3h,3bh,4h,7h,9h,9ah,11h-cyclopenta[a]phenanthren-1-yl]-6-hydroxy-2-methyl-5-oxoheptan-2-yl acetate
2-{7',9',13'-trimethyl-5-methylidene-5'-oxaspiro[oxane-2,6'-pentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosan]-18'-en-14'-oloxy}oxane-3,4,5-triol
methyl 6-[(1s,9as,11s,11ar)-3,11-dihydroxy-3a,6,6,9a,11a-pentamethyl-4,7,10-trioxo-1h,2h,3h,5h,5ah,8h,9h,11h-cyclopenta[a]phenanthren-1-yl]-6-hydroxy-2-methyl-4-oxoheptanoate
4-(acetyloxy)-9-hydroxy-3,6,6,10,14-pentamethyl-13-[(2-methylpropanoyl)oxy]-2-oxo-16-oxatetracyclo[10.3.1.0¹,¹².0⁵,⁷]hexadec-10-en-8-yl 2-methylbut-2-enoate
(2s)-2-{[(2s)-2-({[(2r)-1-[(2s)-2-amino-3-phenylpropanoyl]pyrrolidin-2-yl](hydroxy)methylidene}amino)-1-hydroxy-3-(1h-indol-3-yl)propylidene]amino}-4-methylpentanimidic acid
(2e,5s,6s)-6-[(1r,3r,4r,5ar,9as,9bs,11ar)-3,4,9b-trihydroxy-3,6,6,9a,11a-pentamethyl-7-oxo-1h,2h,4h,5h,5ah,8h,9h,10h,11h-cyclopenta[a]phenanthren-1-yl]-5-(acetyloxy)-2-methylhept-2-enoic acid
3-acetyl-13-(acetyloxy)-8-ethyl-2-hydroxy-5b,8,11a-trimethyl-hexadecahydrocyclobuta[i]chrysen-4-yl 3-hydroxybutanoate
4,6,6-trimethyl-5-[(1e,3e,5e,7e,9e,11e,13e,15e,17e)-3,7,12,16-tetramethyl-18-(2,6,6-trimethyl-5-oxocyclohexa-1,3-dien-1-yl)octadeca-1,3,5,7,9,11,13,15,17-nonaen-1-yl]cyclohexa-2,4-dien-1-one
n-[8-(acetyloxy)-7-[1-(dimethylamino)ethyl]-6,10,15-trimethyl-19-oxapentacyclo[13.3.2.0¹,¹⁴.0³,¹¹.0⁶,¹⁰]icosa-3,17-dien-16-yl]benzenecarboximidic acid
5-(acetyloxy)-6-{3,4,9b-trihydroxy-3,6,6,9a,11a-pentamethyl-7-oxo-1h,2h,4h,5h,5ah,8h,9h,10h,11h-cyclopenta[a]phenanthren-1-yl}-2-methylhept-2-enoic acid
(1r,3s,5s,6ar,7s,8s,10r,10ar)-1,3,10-tris(acetyloxy)-7,8-dimethyl-7-[(2e)-3-methylpenta-2,4-dien-1-yl]-1h,3h,5h,6h,6ah,8h,9h,10h-naphtho[1,8a-c]furan-5-yl 2-methylbutanoate
(2r,3r,4s,5s)-2-[(1s,3as,3br,5as,9as,9bs,11as)-9a,11a-dimethyl-2,7-dioxo-dodecahydro-1h-cyclopenta[a]phenanthren-1-yl]-6-(acetyloxy)-2-hydroxy-4,5,6-trimethylheptan-3-yl acetate
4-[(9e,11e,13e,15e,17e)-18-(4-hydroxy-2,3,6-trimethylphenyl)-3,7,12,16-tetramethyloctadeca-1,3,5,7,9,11,13,15,17-nonaen-1-yl]-2,3,5-trimethylphenol
1-[3-(2-{4-hydroxy-1,5,5-trimethyl-3,6-dioxaspiro[bicyclo[2.2.2]octane-2,2'-oxan]-5'-yl}ethyl)-2,2-dimethyl-6-methylidenecyclohexyl]-2-(2-oxooxolan-3-ylidene)ethyl acetate
(2r)-2-(3-hydroxy-8-methyl-1,4-dioxophenanthren-2-yl)propyl (9z)-octadec-9-enoate
6-hydroxy-2,4,4-trimethyl-3-[(1e,3e,5e,7e,9e,11e,13e,15e,17e)-3,7,12,16-tetramethyl-18-(2,3,6-trimethylphenyl)octadeca-1,3,5,7,9,11,13,15,17-nonaen-1-yl]cyclohexa-2,5-dien-1-one
(3s)-3-[(2r,3s,8s)-5-hydroxy-2,3-dimethyl-8-[(2s)-5-methyl-2-(prop-1-en-2-yl)hex-4-en-1-yl]-8-(3-methylbut-2-en-1-yl)-4,7-dioxo-2,3-dihydro-1-benzopyran-6-yl]-3-phenylpropanoic acid
methyl 10-hydroxy-2-(1-methoxy-2-methyl-1-oxopropan-2-yl)-1-(2-methoxy-2-oxoethyl)-1,4a,4b,9,10-pentamethyl-3,4,5,6,7,8,9,10a,12,12a-decahydro-2h-chrysene-6a-carboxylate
(1r,3as,3br,5as,7s,9ar,9bs,11ar)-7-{[(2r,3s,4r,5s,6s)-3,5-dihydroxy-4-methoxy-6-methyloxan-2-yl]oxy}-3a-hydroxy-11a-methyl-1-(6-oxopyran-3-yl)-tetradecahydrocyclopenta[a]phenanthrene-9a-carbaldehyde
12-o-acetylphorbol-13-decanoate
{"Ingredient_id": "HBIN000922","Ingredient_name": "12-o-acetylphorbol-13-decanoate","Alias": "NA","Ingredient_formula": "C32H48O8","Ingredient_Smile": "CCCCCCCCCC(=O)OC12C(C1(C)C)C3C=C(CC4(C(C3(C(C2OC(=O)C)C)O)C=C(C4=O)C)O)CO","Ingredient_weight": "560.7 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT14160","TCMID_id": "483","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "124027","DrugBank_id": "NA"}
16-O-acetyl-cucurbitacin F
{"Ingredient_id": "HBIN001930","Ingredient_name": "16-O-acetyl-cucurbitacin F","Alias": "NA","Ingredient_formula": "C32H48O8","Ingredient_Smile": "CC(=O)OC1CC2(C3CC=C4C(C3(C(=O)CC2(C1C(C)(C(=O)C=CC(C)(C)O)O)C)C)CC(C(C4(C)C)O)O)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "34976","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
23,24-dihydro-3-epi-isocucurbitacin B
{"Ingredient_id": "HBIN003818","Ingredient_name": "23,24-dihydro-3-epi-isocucurbitacin B","Alias": "NA","Ingredient_formula": "C32H48O8","Ingredient_Smile": "CC(=O)OC(C)(C)CCC(=O)C(C)(C1C(CC2(C1(CC(=O)C3(C2CC=C4C3CC(C(=O)C4(C)C)O)C)C)C)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "41588","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
2,3-dihydroxy-12-oleanene-23,28,30-trioic acid; (2β,3β)-form,23,28-di-me ester
{"Ingredient_id": "HBIN004034","Ingredient_name": "2,3-dihydroxy-12-oleanene-23,28,30-trioic acid; (2\u03b2,3\u03b2)-form,23,28-di-me ester","Alias": "NA","Ingredient_formula": "C32H48O8","Ingredient_Smile": "NA","Ingredient_weight": "560.72","OB_score": "NA","CAS_id": "130756-02-4","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "8944","PubChem_id": "NA","DrugBank_id": "NA"}
(23E)-3β,25-dihydroxytiriicalla-7,23-diene
{"Ingredient_id": "HBIN004081","Ingredient_name": "(23E)-3\u03b2,25-dihydroxytiriicalla-7,23-diene","Alias": "NA","Ingredient_formula": "C32H48O8","Ingredient_Smile": "CC(=O)OC(C)(C)C=CC(=O)C(C)(C1C(CC2(C1(CC(=O)C3(C2CC=C4C3CC(C(C4(C)C)O)O)C)C)C)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "41457","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
3,16,20,25-tetrahydroxycucurbita-5,23-diene-2,11,22-trione; (3β,16α,20r)-form,23,24-dihydro,25-ac
{"Ingredient_id": "HBIN006940","Ingredient_name": "3,16,20,25-tetrahydroxycucurbita-5,23-diene-2,11,22-trione; (3\u03b2,16\u03b1,20r)-form,23,24-dihydro,25-ac","Alias": "NA","Ingredient_formula": "C32H48O8","Ingredient_Smile": "NA","Ingredient_weight": "560.72","OB_score": "NA","CAS_id": "121283-86-1","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "8447","PubChem_id": "NA","DrugBank_id": "NA"}
(4aS,6aR,6bR,8aR,9R,10S,12aS,13R,14aS,14bS)-10-acetoxy-13-hydroxy-2,2,6b,9,12a,14a-hexamethyl-9-methylol-1,3,4,5,6a,7,8,8a,10,11,12,13,14,14b-tetradecahydropicene-4a-carboxylic acid
{"Ingredient_id": "HBIN010244","Ingredient_name": "(4aS,6aR,6bR,8aR,9R,10S,12aS,13R,14aS,14bS)-10-acetoxy-13-hydroxy-2,2,6b,9,12a,14a-hexamethyl-9-methylol-1,3,4,5,6a,7,8,8a,10,11,12,13,14,14b-tetradecahydropicene-4a-carboxylic acid","Alias": "(4aS,6aR,6bR,8aR,9R,10S,12aS,13R,14aS,14bS)-10-acetyloxy-13-hydroxy-9-(hydroxymethyl)-2,2,6b,9,12a,14a-hexamethyl-1,3,4,5,6a,7,8,8a,10,11,12,13,14,14b-tetradecahydropicene-4a-carboxylic acid; (4aS,6aR,6bR,8aR,9R,10S,12aS,13R,14aS,14bS)-10-acetoxy-13-hydroxy-9-(hydroxymethyl)-2,2,6b,9,12a,14a-hexamethyl-1,3,4,5,6a,7,8,8a,10,11,12,13,14,14b-tetradecahydropicene-4a-carboxylic acid","Ingredient_formula": "C32H48O8","Ingredient_Smile": "NA","Ingredient_weight": "560.72","OB_score": "17.83815774","CAS_id": "130756-02-4","SymMap_id": "SMIT05853","TCMID_id": "NA","TCMSP_id": "MOL003838","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
acinospesigenin
{"Ingredient_id": "HBIN014555","Ingredient_name": "acinospesigenin","Alias": "NA","Ingredient_formula": "C32H48O8","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT14169","TCMID_id": "545","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}