(4R)-4-[(1R,3aS,3bR,4R,5aS,7R,9aS,9bS,11aR)-4,7-dihydroxy-9a,11a-dimethyl-hexadecahydro-1H-cyclopenta[a]phenanthren-1-yl]pentanoic acid

Compound number:
MolPort-001-794-647
CAS number: 128-13-2; 474-25-9
IUPAC:
(4R)-4-[(1R,3aS,3bR,4R,5aS,7R,9aS,9bS,11aR)-4,7-dihydroxy-9a,11a-dimethyl-hexadecahydro-1H-cyclopenta[a]phenanthren-1-yl]pentanoic acid
IUPAC traditional:
chenodeoxycholic acid
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]3CC[C@]12C
InChI key:
RUDATBOHQWOJDD-BSWAIDMHSA-N
Molecular formula:
C24H40O4
Molecular weight: 392.58

Marketplace Offers

Price range: from to USD Pack size: from to mg
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Supplier Catalogue Data


Catalog: Screening compound Ships out: 7 business days Purity: n/a
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100 mg June 4, 2019 64.90 USD
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500 mg June 4, 2019 102.66 USD
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Catalog: Screening compound Ships out: 7 business days Purity: n/a
Last updated: 3 months ago In warehouse: Unverified Salt: Free Base
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50 mg June 4, 2019 114.00 USD
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Catalog: Screening compound Ships out: 5 business days Purity: >=98%
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20 mg May 31, 2019 30.00 USD
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Catalog: Screening compound Ships out: 10 business days Purity: n/a
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5 g June 7, 2019 45.00 USD
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10 g June 7, 2019 75.00 USD
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25 g June 7, 2019 150.00 USD
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Catalog: Building blocks Ships out: 2 business days Purity: >98% (HPLC), powder
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25 mg May 28, 2019 19.00 USD
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100 mg May 28, 2019 29.00 USD
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1 g May 28, 2019 38.00 USD
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Catalog: Building blocks Ships out: 10 business days Purity: 97%
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5 g June 7, 2019 12.00 USD
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10 g June 7, 2019 17.00 USD
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25 g June 7, 2019 33.00 USD
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S&H to USA: 80.00 USD
S&H to World: 100.00 USD

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Catalog: Building blocks Ships out: 10 business days Purity: 97%
Last updated: this week In warehouse: Unverified
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1 g June 7, 2019 28.00 USD
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5 g June 7, 2019 31.00 USD
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25 g June 7, 2019 57.00 USD
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S&H to USA: 105.00 USD
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Catalog: Made to order Ships out: 30 business days Purity: 95%
In warehouse: Made to order
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25 g July 5, 2019 68.44 USD
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100 g July 5, 2019 191.63 USD
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More Information

Compound Identifiers
Compound number: MolPort-001-794-647
CAS number: 128-13-2; 474-25-9

Names, Synonyms and 3rd Party Identifiers
Name: ZINC000003914808
MFCD00064142
17ß-(1-Methyl-3-carboxypropyl)etiocholane-3a,7a-diol
(3α,5β,7α)-3,7-Dihydroxycholan-24-oic acid
(3a,5ß,7a)-3,7-Dihydroxycholan-24-oic Acid
(4R)-4-[(1S,2S,5R,7S,9R,10R,11S,14R,15R)-5,9-dihydroxy-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadecan-14-yl]pentanoic acid
(4R)-4-((1S,2S,7S,11S,5R,9R,10R,14R,15R)-5,9-dihydroxy-2,15-dimethyltetracyclo [8.7.0.0<2,7>.0<11,15>]heptadec-14-yl)pentanoic acid
"5β-Cholanic Acid-3α,7α-diol, 3α,7α-Dihydroxy-5β-cholanic Acid"
CDCA
Chendol
Chenocol
(+)-Chenodeoxycholic Acid
chenodeoxycholic acid
Chenodiol
Chenodiol, Chenodesoxycholic acid
Chenodiol, Chenodesoxycholic acid, Chenocholic acid
Cholan-24-oic acid, 3,7-dihydroxy-, (3a,5b,7a)-
Fluibil

InChI
InChI: 1S/C24H40O4/c1-14(4-7-21(27)28)17-5-6-18-22-19(9-11-24(17,18)3)23(2)10-8-16(25)12-15(23)13-20(22)26/h14-20,22,25-26H,4-13H2,1-3H3,(H,27,28)/t14-,15+,16-,17-,18+,19+,20-,22+,23+,24-/m1/s1
InChI key: RUDATBOHQWOJDD-BSWAIDMHSA-N

Calculated Properties
Molecular formula: C24H40O4
Molecular weight: 392.58

Other

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2019 MolPort, v2.94, release date 24-05-2019 14:00 (+0200). All rights reserved.
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