CAS
35013-61-1 Purity
99%
35013-61-1 Purity
99%
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5β-Androstan-3α-ol-17-one glucosiduronate
CAS
3602-09-3
Catalog Number
ACM3602093
Category
Steroidal Compounds
Molecular Weight
466.56
Molecular Formula
C25H38O8
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Specification
Synonyms
5β-Androsterone β-D-Glucuronide; 3alpha-hydroxy-5beta-androstan-17-one 3-glucosiduronic acid; 3ALPHA-HYDROXY-5BETA-ANDROSTAN-17-ONE 3-GLUCURONIDE;
IUPAC Name
(2S,3S,4S,5R,6R)-6-[[(3R,5R,8R,9S,10S,13S,14S)-10,13-dimethyl-17-oxo-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
Canonical SMILES
CC12CCC(CC1CCC3C2CCC4(C3CCC4=O)C)OC5C(C(C(C(O5)C(=O)O)O)O)O
InChI Key
VFUIRAVTUVCQTF-SDHZCXLISA-N
Boiling Point
656.1ºC at 760mmHg
Flash Point
219.5ºC
Density
1.34g/cm³
Exact Mass
466.25700
H-Bond Acceptor
8
H-Bond Donor
4
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