Methyl 3-alpha,7-alpha-diacetoxy-12-alpha-hydroxy-5-beta-cholan-24-oate

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Catalog Number
ACM3749879
Product Name
Methyl 3-alpha,7-alpha-diacetoxy-12-alpha-hydroxy-5-beta-cholan-24-oate
Structure
Structure
CAS
3749-87-9
Category
Heterocyclic Organic Compound
Synonyms
3α,7α-Diacetoxy-12α-hydroxy-5β-cholan-24-saeure-methylester; methyl 3α,7α-diacetoxy-12α-hydroxy cholanate; 12α-Hydroxy-3α,7α-diacetoxy-5β-cholansaeure-(24)-methylester; methyl 3,7-diacetoxych
IUPAC Name
methyl (4R)-4-[(3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-3,7-diacetyloxy-12-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoate
Molecular Weight
506.671340 [g/mol]
Molecular Formula
C29H46O7
Canonical SMILES
CC(CCC(=O)OC)C1CCC2C1(C(CC3C2C(CC4C3(CCC(C4)OC(=O)C)C)OC(=O)C)O)C
InChI Key
VKXXPYARELKQOY-CXFLVZIOSA-N
EC Number
223-151-6
Exact Mass
506.32400
H-Bond Acceptor
7
H-Bond Donor
1
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