5β-Androstan-3α-ol-17-one glucosiduronate

• Catalog Number: ACM3602093
• Product Name: 5β-Androstan-3α-ol-17-one glucosiduronate
• CAS: 3602-09-3
• Category: Steroidal Compounds
• 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
• Molecular Weight: 466.56
• Molecular Formula: C₂₅H₃₈O₈
• 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