CAS
210580-38-4 Purity
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210580-38-4 Purity
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![Methyl4-(3-ethoxycarbonyloxy-10,13-dimethyl-7,12-dioxo-2,3,4,5,6,8,9,11,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoate](https://resource.alfa-chemistry.com/structure/21059-42-7.gif)
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Methyl 3alpha-[(ethoxycarbonyl)oxy]-12alpha-hydroxy-7-oxo-5beta-cholan-24-oate
CAS
21059-40-5
Catalog Number
ACM21059405
Category
Other Products
Molecular Weight
492.645 g/mol
Molecular Formula
C28H44O7
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Specification
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
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
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