Exact Mass: 532.3552407999999
Exact Mass Matches: 532.3552407999999
Found 352 metabolites which its exact mass value is equals to given mass value 532.3552407999999
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
5b-Cyprinol sulfate
5b-Cyprinol sulfate is an intermediate in bile acid biosynthesis. Bile acids are steroid acids found predominantly in the bile of mammals. The distinction between different bile acids is minute, depending only on the presence or absence of hydroxyl groups on positions 3, 7, and 12. Bile acids are physiological detergents that facilitate excretion, absorption, and transport of fats and sterols in the intestine and liver. Bile acids are also steroidal amphipathic molecules derived from the catabolism of cholesterol. They modulate bile flow and lipid secretion, are essential for the absorption of dietary fats and vitamins, and have been implicated in the regulation of all the key enzymes involved in cholesterol homeostasis. Bile acids recirculate through the liver, bile ducts, small intestine and portal vein to form an enterohepatic circuit. They exist as anions at physiological pH and, consequently, require a carrier for transport across the membranes of the enterohepatic tissues. The unique detergent properties of bile acids are essential for the digestion and intestinal absorption of hydrophobic nutrients. Bile acids have potent toxic properties (e.g. membrane disruption) and there are a plethora of mechanisms to limit their accumulation in blood and tissues (PMID: 11316487, 16037564, 12576301, 11907135). 5b-Cyprinol sulfate is an intermediate in bile acid biosynthesis. Bile acids are steroid acids found predominantly in bile of mammals. The distinction between different bile acids is minute, depends only on presence or absence of hydroxyl groups on positions 3, 7, and 12. Bile acids are physiological detergents that facilitate excretion, absorption, and transport of fats and sterols in the intestine and liver. Bile acids are also steroidal amphipathic molecules derived from the catabolism of cholesterol. They modulate bile flow and lipid secretion, are essential for the absorption of dietary fats and vitamins, and have been implicated in the regulation of all the key enzymes involved in cholesterol homeostasis. Bile acids recirculate through the liver, bile ducts, small intestine and portal vein to form an enterohepatic circuit. They exist as anions at physiological pH and, consequently, require a carrier for transport across the membranes of the enterohepatic tissues. The unique detergent properties of bile acids are essential for the digestion and intestinal absorption of hydrophobic nutrients. Bile acids have potent toxic properties (e.g., membrane disruption) and there are a plethora of mechanisms to limit their accumulation in blood and tissues. (PMID: 11316487, 16037564, 12576301, 11907135) [HMDB]
Alisol A 24-acetate
Phytolaccagenin
Phytolaccagenin is a natural product found in Anisomeria coriacea, Phytolacca dodecandra, and other organisms with data available. Phytolaccagenin, a triterpenoid saponin, is the active component of Radix Phytolaccae. Phytolcaccagenin has antifungal activity, anti-inflammatory activity and lower toxicity[1] Phytolaccagenin, a triterpenoid saponin, is the active component of Radix Phytolaccae. Phytolcaccagenin has antifungal activity, anti-inflammatory activity and lower toxicity[1]
Alisol A monoacetate
alisol A 24-acetate is a natural product found in Alisma with data available. Alisol A 24-acetate (Alisol A 24-monoacetate) is a natural product. Alisol A 24-acetate (Alisol A 24-monoacetate) is a natural product.
Alisol
alisol A 24-acetate is a natural product found in Alisma with data available. Alisol A 24-acetate (Alisol A 24-monoacetate) is a natural product. Alisol A 24-acetate (Alisol A 24-monoacetate) is a natural product.
(3beta,5beta,22R)-3,22-Di-Ac-3,14,22,25-Tetrahydroxycholest-7-en-6-one
3alpha-acetoxy-21,24R-epoxyapotirucall-14-ene-7alpha,23R,25-triol
(8S)-8-(6-O-acetyl-b-D-glucopyranosyloxy)eicosanoic acid
(-)-dictyostatin|(-)dictyostatin|(7R,8S,10S,13S,14R,15S,17S,20R,21S,22S)-8,10,14,20-tetrahydroxy-7,13,15,17,21-pentamethyl-22-((1S)-1-methylpenta-2,4-dienyl)oxacyclodocosa-3,5,11-trien-2-one|(8S,10S,14R,20R)-tetrahydroxy-(7R,13S,15S,17S,21S)-pentamethyl-(22S)-((1S)-methylpenta-2,4-dienyl)oxacyclodocosa-3,5,11-trien-2-one|8S,10S,14R,20R-tetrahydroxy-7R,13S,15S,17S,21S-pentamethyl-22S-(1S-methylpenta-2,4-dienyl)oxacyclodocosa-3,5,11-trien-2-one|dictyostatin|dicytostatin
6alpha-Acetoxy-16beta,22-dihydroxyhopan-24-oic acid
6-Deacetylcephalosporin P1|6-Desacetyl-cephalosporin P(1)
5beta,6beta-epoxygorgostane-3beta,7alpha,11alpha,12beta-tetrol 12-acetate
(16beta,22R)-16,18-Di-Ac-4,16,18,22-Tetrahdroxycholest-4-en-3-one
25-nor-12alpha-acetoxy-16beta-(3-hydroxybutanoyloxy)-20,24-dimethyl-24-oxoscalarane
3beta-acetoxy-urs-12-ene-1beta,2alpha,20beta-tetraol
21-O-beta-D-glucopyranosyl-18S-hydroxydihydroprotolichesterinate
cholest-4-en-4,16beta,18,22R-tetrol-3-one 16,18-diacetate
3alpha,19alpha-dihydroxy-12alpha-methoxydubos-13(14)-ene-24,28-dioic acid|duboscic acid
2alpha,3beta,19alpha-trihydroxyurs-12-ene-23,28-dioic acid-23-methyl ester
(23R,24S)-23,24,25-trihydroxy-3-oxotirucall-7-en-21-yl acetate|brumollisol C
(6S)-6-(6-O-acetyl-b-D-glucopyranosyloxy)eicosanoic acid
7??,21S,25-Trihydroxy-3??-acetoxy-21S,23R-epoxy-9(11)-en-dammarane
(3beta,5alpha,6beta,15alpha,24S)-15-Sulfate,Cholestane-3,5,6,15,24-Pentol
28-Ac-(3beta,16alpha,21beta,22alpha)-12-Oleanene-3,16,21,22,28-pentol
(22R)-5beta,6beta-epoxy-24-methyl-5alpha-cholestan-3beta,22,25-triol-3,22-diacetate
2-O,3-O-diangeloyl-alpha-bisabolol-beta-D-fucopyranoside
(1alpha,3beta,7alpha,11alpha,12beta)-gorgost-5-ene-1,3,7,11,12-pentol 12-acetate
(3beta,5alpha,6beta,15alpha,16beta)-16-Sulfate,Cholestane-3,5,6,15,16-Pentol
23-methylester of 20(S)-3beta,19alpha,24-trihydroxyurs-12-en-23,28-dioic acid|sapogenin
(6R)-2-hydroxy-2-methyl-6-((3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)heptyl hydrogen sulfate
(6R)-2-(hydroxymethyl)-6-((3R,5R,7R,8R,9S,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)heptyl hydrogen sulfate
Lys Met Arg Val
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Arg Thr Arg Thr
Arg Thr Thr Arg
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1α,25-dihydroxy-22-oxavitamin D3 3-hemiglutarate/ 1α,25-dihydroxy-22-oxacholecalciferol 3-hemiglutarate
IC202B
A C-nitro compound isolated from Streptoalloteichus sp.1454-19. It is a siderophore which exhibits immunosuppressive activity on a mixed lymphocyte culture reaction (MLCR).
3-O-alpha-L-rhamnopyranosyl-3-hydroxydodecanoyl-3-hydroxydecanoic acid
1alpha,25-dihydroxy-22-oxavitamin D3 3-hemiglutarate/ 1alpha,25-dihydroxy-22-oxacholecalciferol 3-hemiglutarate
Uncariursanic acid
(2S)-2-[bis(carboxymethyl)amino]-6-(16-sulfanylhexadecanoylamino)hexanoic acid
1,4,7,10-tetrabenzyl-1,4,7,10-tetrazacyclododecane
titanium diisopropoxide bis(tetramethylheptanedionate)
1-(4-butoxyphenyl)-N-[4-[2-[4-[(4-butoxyphenyl)methylideneamino]phenyl]ethyl]phenyl]methanimine
C36H40N2O2 (532.3089620000001)
1alpha,25-dihydroxy-22-oxavitamin D3 3-hemiglutarate/1alpha,25-dihydroxy-22-oxacholecalciferol 3-hemiglutarate
Combretic acid A
A pentacyclic triterpenoid that is 9beta,19-cyclolanostan-28-oic acid substituted by an acetyloxy group at position 7 and hydroxy groups at positions 3 and 25. It has been isolated from the leaves of Combretum quadrangulare.
3-O-(alpha-L-olivosyl)erythronolide B
A macrolide that is erythronolide B having a 2,6-dideoxy-alpha-L-arabino-hexopyranosyl (alpha-L-olivosyl) residue attached at position 3.
1-cyclohexyl-3-[(3R,9S,10S)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-(methylaminomethyl)-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]urea
C29H48N4O5 (532.3624517999999)
1-cyclohexyl-3-[(3S,9S,10S)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-(methylaminomethyl)-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]urea
C29H48N4O5 (532.3624517999999)
(6R)-2-hydroxy-2-methyl-6-((3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)heptyl hydrogen sulfate
1-cyclohexyl-3-[(3R,9R,10S)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-(methylaminomethyl)-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]urea
C29H48N4O5 (532.3624517999999)
1-cyclohexyl-3-[(3R,9R,10R)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-(methylaminomethyl)-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]urea
C29H48N4O5 (532.3624517999999)
1-cyclohexyl-3-[(3S,9R,10S)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-(methylaminomethyl)-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]urea
C29H48N4O5 (532.3624517999999)
1-cyclohexyl-3-[(3S,9R,10R)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-(methylaminomethyl)-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]urea
C29H48N4O5 (532.3624517999999)
1-cyclohexyl-3-[(3S,9S,10R)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-(methylaminomethyl)-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]urea
C29H48N4O5 (532.3624517999999)
1-cyclohexyl-3-[(3S,9S,10S)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-(methylaminomethyl)-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]urea
C29H48N4O5 (532.3624517999999)
1-cyclohexyl-3-[(3R,9R,10R)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-(methylaminomethyl)-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]urea
C29H48N4O5 (532.3624517999999)
1-cyclohexyl-3-[(3R,9S,10R)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-(methylaminomethyl)-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]urea
C29H48N4O5 (532.3624517999999)
1-cyclohexyl-3-[(3S,9R,10S)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-(methylaminomethyl)-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]urea
C29H48N4O5 (532.3624517999999)
1-cyclohexyl-3-[(3R,9S,10R)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-(methylaminomethyl)-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]urea
C29H48N4O5 (532.3624517999999)
[2-(Hydroxymethyl)-6-[(3R,5R,7R,8R,9S,12S,14S,17R)-3,7,12-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]heptyl] hydrogen sulfate
(6R)-2-(hydroxymethyl)-6-((3R,5R,7R,8R,9S,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)heptyl hydrogen sulfate
[2-(hydroxymethyl)-6-[(3R,7R,12S)-3,7,12-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]heptyl] hydrogen sulate
2-[hydroxy-[(2R)-2-hydroxy-3-[(10Z,13Z,16Z)-nonadeca-10,13,16-trienoyl]oxypropoxy]phosphoryl]oxyethyl-trimethylazanium
[(4E,8E)-3-hydroxy-2-(octanoylamino)tetradeca-4,8-dienyl] 2-(trimethylazaniumyl)ethyl phosphate
[(4E,8E)-3-hydroxy-2-(nonanoylamino)trideca-4,8-dienyl] 2-(trimethylazaniumyl)ethyl phosphate
[(4E,8E)-2-(butanoylamino)-3-hydroxyoctadeca-4,8-dienyl] 2-(trimethylazaniumyl)ethyl phosphate
[(4E,8E)-3-hydroxy-2-(pentanoylamino)heptadeca-4,8-dienyl] 2-(trimethylazaniumyl)ethyl phosphate
[(E)-3-hydroxy-2-[[(Z)-tridec-9-enoyl]amino]non-4-enyl] 2-(trimethylazaniumyl)ethyl phosphate
[(4E,8E)-3-hydroxy-2-(propanoylamino)nonadeca-4,8-dienyl] 2-(trimethylazaniumyl)ethyl phosphate
[(4E,8E)-2-(hexanoylamino)-3-hydroxyhexadeca-4,8-dienyl] 2-(trimethylazaniumyl)ethyl phosphate
[(4E,8E)-2-(heptanoylamino)-3-hydroxypentadeca-4,8-dienyl] 2-(trimethylazaniumyl)ethyl phosphate
[(4E,8E)-2-acetamido-3-hydroxyicosa-4,8-dienyl] 2-(trimethylazaniumyl)ethyl phosphate
[(4E,8E)-2-(decanoylamino)-3-hydroxydodeca-4,8-dienyl] 2-(trimethylazaniumyl)ethyl phosphate
[1-propanoyloxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-2-yl] (Z)-pentadec-9-enoate
[1-pentanoyloxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-2-yl] (Z)-tridec-9-enoate
[1-acetyloxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-2-yl] (Z)-hexadec-9-enoate
[1-butanoyloxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-2-yl] (Z)-tetradec-9-enoate
[(E)-3-hydroxy-2-[[(Z)-tetradec-9-enoyl]amino]oct-4-enyl] 2-(trimethylazaniumyl)ethyl phosphate
(1-pentanoyloxy-3-phosphonooxypropan-2-yl) (9Z,12Z)-nonadeca-9,12-dienoate
(1-acetyloxy-3-phosphonooxypropan-2-yl) (13Z,16Z)-docosa-13,16-dienoate
(1-hexanoyloxy-3-phosphonooxypropan-2-yl) (9Z,12Z)-octadeca-9,12-dienoate
(1-butanoyloxy-3-phosphonooxypropan-2-yl) (11Z,14Z)-icosa-11,14-dienoate
(1-octanoyloxy-3-phosphonooxypropan-2-yl) (9Z,12Z)-hexadeca-9,12-dienoate
(1-heptanoyloxy-3-phosphonooxypropan-2-yl) (9Z,12Z)-heptadeca-9,12-dienoate
(1-phosphonooxy-3-propanoyloxypropan-2-yl) (11Z,14Z)-henicosa-11,14-dienoate
2-[Carboxy-[2,3-di(nonanoyloxy)propoxy]methoxy]ethyl-trimethylazanium
2-[Carboxy-(2-decanoyloxy-3-octanoyloxypropoxy)methoxy]ethyl-trimethylazanium
2-[hydroxy-[2-hydroxy-3-[(11Z,14Z,17Z)-icosa-11,14,17-trienoxy]propoxy]phosphoryl]oxyethyl-trimethylazanium
2-[[3-[(7Z,10Z,13Z)-hexadeca-7,10,13-trienoxy]-2-propanoyloxypropoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium
TG(29:4)
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(1s,3as,5as,7s,9ar,9br,11as)-1-[(2s,3r,5r)-5-[(1s)-1,2-dihydroxy-2-methylpropyl]-2-hydroxyoxolan-3-yl]-3a,6,6,9a,11a-pentamethyl-1h,2h,3h,5h,5ah,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-7-yl acetate
(2s,3r,4s,5s,6r)-5-hydroxy-6-methyl-2-{[(2r)-6-methyl-2-[(1s)-4-methylcyclohex-3-en-1-yl]hept-5-en-2-yl]oxy}-4-{[(2z)-2-methylbut-2-enoyl]oxy}oxan-3-yl (2z)-2-methylbut-2-enoate
(1r,5r,9s,10s,13s,15r,16r,19r,20r,21r)-9,19-dihydroxy-13-methoxy-1,8,8,16,20-pentamethylpentacyclo[13.8.0.0²,¹¹.0⁵,¹⁰.0¹⁶,²¹]tricos-2(11)-ene-5,20-dicarboxylic acid
(1s,2r,3r,4as,4br,6as,7r,10as,10br,12r,12as)-2-acetyl-7-ethyl-1-formyl-12-hydroxy-4b,7,10a,12a-tetramethyl-tetradecahydrochrysen-3-yl 3-hydroxypentanoate
(2r,3s,5r)-2-[(1s,3as,3br,5as,9as,9bs,11as)-9a,11a-dimethyl-7-oxo-tetradecahydrocyclopenta[a]phenanthren-1-yl]-6-(acetyloxy)-2-hydroxy-5,6-dimethylheptan-3-yl acetate
(3e,5e,7r,8r,9e,13e,16s)-8-hydroxy-3,5,7-trimethyl-16-[(2s,4e,7s,8r,9s,10r,11s)-7,9,11-trihydroxy-8,10-dimethyldodec-4-en-2-yl]-1-oxacyclohexadeca-3,5,9,13-tetraen-2-one
methyl 3-[(1r,2r,5s,6r,8r,10r,11s,12r,15s)-10-hydroxy-5-[(2r)-2-hydroxy-6-methyl-4-oxohept-5-en-2-yl]-1,2,11-trimethyl-9-oxatetracyclo[6.6.1.0²,⁶.0¹¹,¹⁵]pentadecan-12-yl]-3-methyl-2-oxobutanoate
6-{9a,11a-dimethyl-7-oxo-tetradecahydrocyclopenta[a]phenanthren-1-yl}-5-(acetyloxy)-6-hydroxy-2,3-dimethylheptan-2-yl acetate
(1s,2s,3r,4as,4br,6as,7s,10as,10br,12r,12as)-2-acetyl-7-ethyl-1-formyl-12-hydroxy-4b,7,10a,12a-tetramethyl-tetradecahydrochrysen-3-yl (3s)-3-hydroxypentanoate
(3s,4s,6r)-6-[(3ar,3bs,9as,9bs,10s)-10-hydroxy-3a,3b,6,6,9a-pentamethyl-7-oxo-2h,3h,4h,5h,5ah,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl]-2,3-dihydroxy-2-methylheptan-4-yl acetate
(1s,2r,5s,7s,9r,10s,11s,12s,15r,16r,17s,18s)-5,10,18-trihydroxy-2,16-dimethyl-15-[(1r)-1-[(1r,2r)-2-methyl-2-[(2r)-3-methylbutan-2-yl]cyclopropyl]ethyl]-8-oxapentacyclo[9.7.0.0²,⁷.0⁷,⁹.0¹²,¹⁶]octadecan-17-yl acetate
[(1r,3s,3ar,5as,5bs,6s,7as,9r,10r,11as,13ar,13br)-1,6,9,10-tetrahydroxy-3-isopropyl-5a,8,8,11a,13a-pentamethyl-1h,2h,3h,4h,5h,5bh,6h,7h,7ah,9h,10h,11h,13h,13bh-cyclopenta[a]chrysen-3a-yl]methyl acetate
2-acetyl-12-(acetyloxy)-7-ethyl-4b,7,10a,12a-tetramethyl-tetradecahydrochrysen-3-yl 3-hydroxybutanoate
1-(5-methoxyoxolan-3-yl)-3b,6,6,9a,11a-pentamethyl-7-oxo-1h,2h,4h,5h,5ah,9bh,10h,11h-cyclopenta[a]phenanthren-4-yl benzoate
(1s,2r,3'ar,3'br,4r,5'ar,7'r,9'ar,9'br,11'r,11'ar)-7'-hydroxy-4-(2-hydroxypropan-2-yl)-1,3'a,3'b,6',6',9'a-hexamethyl-dodecahydro-3,7-dioxaspiro[bicyclo[2.2.1]heptane-2,1'-cyclopenta[a]phenanthren]-11'-yl acetate
2- methybicyclo(4. 3. 0)non- 1(6)- ene
{"Ingredient_id": "HBIN005931","Ingredient_name": "2- methybicyclo(4. 3. 0)non- 1(6)- ene","Alias": "NA","Ingredient_formula": "C32H52O4S","Ingredient_Smile": "CC(C)C(=O)C12C=CC(C(C1=O)(CC(C2(C)CCCC(C)(C)OC)CC=C(C)C)CC=C(C)C)S(=O)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "34877","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
alisol e 23-acetate
{"Ingredient_id": "HBIN015156","Ingredient_name": "alisol e 23-acetate","Alias": "[(3S,4S,6R)-2,3-dihydroxy-6-[(8S,9S,10S,11S,14R)-11-hydroxy-4,4,8,10,14-pentamethyl-3-oxo-1,2,5,6,7,9,11,12,15,16-decahydrocyclopenta[a]phenanthren-17-yl]-2-methylheptan-4-yl] acetate; AC1NSVD1","Ingredient_formula": "C32H52O6","Ingredient_Smile": "CC(CC(C(C(C)(C)O)O)OC(=O)C)C1=C2CC(C3C4(CCC(=O)C(C4CCC3(C2(CC1)C)C)(C)C)C)O","Ingredient_weight": "532.8 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT14231","TCMID_id": "897","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "101661272","DrugBank_id": "NA"}
alisol e 24-acetate
{"Ingredient_id": "HBIN015157","Ingredient_name": "alisol e 24-acetate","Alias": "NA","Ingredient_formula": "C32H52O6","Ingredient_Smile": "CC(CC(C(C(C)(C)O)OC(=O)C)O)C1=C2CC(C3C4(CCC(=O)C(C4CCC3(C2(CC1)C)C)(C)C)C)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT14232","TCMID_id": "898","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}