Methyl 3alpha-[(ethoxycarbonyl)oxy]-12alpha-hydroxy-7-oxo-5beta-cholan-24-oate

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Catalog Number
ACM21059405
Product Name
Methyl 3alpha-[(ethoxycarbonyl)oxy]-12alpha-hydroxy-7-oxo-5beta-cholan-24-oate
Structure
Structure
CAS
21059-40-5
Category
Heterocyclic Organic Compound
Synonyms
CID89424, EINECS 244-183-7, Methyl 3alpha-((ethoxycarbonyl)oxy)-12alpha-hydroxy-7-oxo-5beta-cholan-24-oate, 21059-40-5
IUPAC Name
methyl 4-(3-ethoxycarbonyloxy-12-hydroxy-10,13-dimethyl-7-oxo-1,2,3,4,5,6,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl)pentanoate
Molecular Weight
492.645 g/mol
Molecular Formula
C28H44O7
Canonical SMILES
CCOC(=O)OC1CCC2(C(C1)CC(=O)C3C2CC(C4(C3CCC4C(C)CCC(=O)OC)C)O)C
InChI Key
JSTLLHLKEQTGOF-UHFFFAOYSA-N
Boiling Point
595.9ºC at 760mmHg
Flash Point
188ºC
Density
1.16g/cm³
EC Number
244-183-7
Exact Mass
492.30900
H-Bond Acceptor
7
H-Bond Donor
1
MSDS
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COA
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Spec Sheet
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