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CAS RN 81-25-4

CH3(R)HOO(R)(S)(R)(R)HO(S)(R)OH(S)H3C(S)(S)HO(R)H3C

CAS RN 81-25-4

IUPAC Name: (4R)-4-[(1R,3aS,3bR,4R,5aS,7R,9aS,9bS,11S,11aR)-4,7,11-trihydroxy-9a,11a-dimethyl-hexadecahydro-1H-cyclopenta[a]phenanthren-1-yl]pentanoic acid
Synonyms: cholic acid 胆酸 cholsaeure
Molecular Weight (g/mol): 408.58
Molecular Formula: C24H40O5
InChi Key: BHQCQFFYRZLCQQ-OELDTZBJSA-N
SMILES: C[C@H](CCC(O)=O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C
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Thermo Scientific Chemicals Cholic acid, 97%

CAS: 81-25-4 Molecular Formula: C24H40O5 MDL Number: MFCD00003672 InChI Key: BHQCQFFYRZLCQQ-OELDTZBJSA-N Synonym: cholic acid,cholalic acid,cholate,cholalin,colalin,cholsaeure,cholbam,cholicacid,cholic acid, 5beta,3alpha,7alpha,12alpha-trihydroxy-5beta-cholanic acid PubChem CID: 221493 ChEBI: CHEBI:16359

EDGE
PubChem CID 221493
CAS 81-25-4
ChEBI CHEBI:16359
MDL Number MFCD00003672
Synonym cholic acid,cholalic acid,cholate,cholalin,colalin,cholsaeure,cholbam,cholicacid,cholic acid, 5beta,3alpha,7alpha,12alpha-trihydroxy-5beta-cholanic acid
InChI Key BHQCQFFYRZLCQQ-OELDTZBJSA-N
Molecular Formula C24H40O5
2

Cholic acid, 97%, Thermo Scientific Chemicals

CAS: 81-25-4 Molecular Formula: C24H40O5 Molecular Weight (g/mol): 408.579 MDL Number: MFCD00003672 InChI Key: BHQCQFFYRZLCQQ-OELDTZBJSA-N Synonym: cholic acid,cholalic acid,cholate,cholalin,colalin,cholsaeure,cholbam,cholicacid,cholic acid, 5beta,3alpha,7alpha,12alpha-trihydroxy-5beta-cholanic acid PubChem CID: 221493 ChEBI: CHEBI:16359 IUPAC Name: (4R)-4-[(3R,5S,7R,8R,9S,10S,12S,13R,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]pentanoic acid SMILES: CC(CCC(=O)O)C1CCC2C1(C(CC3C2C(CC4C3(CCC(C4)O)C)O)O)C

EDGE
PubChem CID 221493
CAS 81-25-4
Molecular Weight (g/mol) 408.579
ChEBI CHEBI:16359
MDL Number MFCD00003672
SMILES CC(CCC(=O)O)C1CCC2C1(C(CC3C2C(CC4C3(CCC(C4)O)C)O)O)C
Synonym cholic acid,cholalic acid,cholate,cholalin,colalin,cholsaeure,cholbam,cholicacid,cholic acid, 5beta,3alpha,7alpha,12alpha-trihydroxy-5beta-cholanic acid
IUPAC Name (4R)-4-[(3R,5S,7R,8R,9S,10S,12S,13R,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]pentanoic acid
InChI Key BHQCQFFYRZLCQQ-OELDTZBJSA-N
Molecular Formula C24H40O5
4

Cholic Acid, TRC

CAS: 81-25-4 Chemical Name or Material: Cholic Acid Formula Weight: 408.2876 InChI Formula: InChI=1S/C24H40O5/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26/h13-20,22,25-27H,4-12H2,1-3H3,(H,28,29)/t13-,14+,15-,16-,17+,18+,19-,20+,22+,23+,24-/m1/s1 IUPAC Name: (4R)-4-[(3R,5S,7R,8R,9S,10S,12S,13R,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]pentanoic acid Molecular Formula: C24 H40 O5 Molecular Weight (g/mol): 408.57 Percent Purity: >95% Purity Grade Notes: HPLC Recommended Storage: +4°C SMILES: C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C Synonym: Cholic Acid,(3α,5β,7α,12α)-3,7,12-Trihydroxycholan-24-oic acid,Cholic acid,17β-[1-Methyl-3-carboxypropyl]etiocholane-3α,7α,12α-triol,3α,7α,12α-Trihydroxy-5β-cholan-24-oic acid,3α,7α,12α-Trihydroxy-5β-cholanic acid,3α,7α,12α-Trihydroxy-5β-cholanoic acid,3α,7α,12α-Trihydroxy-β-cholanic acid,3α,7α,12α-Trihydroxycholanic acid,5β-Cholanic acid-3α,7α,12α-triol,5β-Cholic acid,Cholalic acid,Cholalin,Colalin,E 1000,NSC-6135,Cholan-24-oic acid, 3,7,12-trihydroxy-, (3α,5β,7α,12α)-

Percent Purity >95%
CAS 81-25-4
Molecular Weight (g/mol) 408.57
InChI Formula InChI=1S/C24H40O5/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26/h13-20,22,25-27H,4-12H2,1-3H3,(H,28,29)/t13-,14+,15-,16-,17+,18+,19-,20+,22+,23+,24-/m1/s1
Chemical Name or Material Cholic Acid
Synonym Cholic Acid,(3α,5β,7α,12α)-3,7,12-Trihydroxycholan-24-oic acid,Cholic acid,17β-[1-Methyl-3-carboxypropyl]etiocholane-3α,7α,12α-triol,3α,7α,12α-Trihydroxy-5β-cholan-24-oic acid,3α,7α,12α-Trihydroxy-5β-cholanic acid,3α,7α,12α-Trihydroxy-5β-cholanoic acid,3α,7α,12α-Trihydroxy-β-cholanic acid,3α,7α,12α-Trihydroxycholanic acid,5β-Cholanic acid-3α,7α,12α-triol,5β-Cholic acid,Cholalic acid,Cholalin,Colalin,E 1000,NSC-6135,Cholan-24-oic acid, 3,7,12-trihydroxy-, (3α,5β,7α,12α)-
SMILES C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C
Recommended Storage +4°C
Purity Grade Notes HPLC
Molecular Formula C24 H40 O5
IUPAC Name (4R)-4-[(3R,5S,7R,8R,9S,10S,12S,13R,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]pentanoic acid
Formula Weight 408.2876
5

3alpha,7alpha,12alpha-Trihydroxy-5beta-cholan-24-oic Acid (Cholic Acid), Mikromol™

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