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Structure

5β-Dihydrocortisone acetate 21-acetate

CAS
1499-59-8
Catalog Number
ACM1499598
Category
Steroidal Compounds
Molecular Weight
404.5
Molecular Formula
C23H32O6

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Specification

Synonyms
17-alpha,21-dihydroxy-5-beta-pregnane-3,11,20-trione 21-acetate;NSC22843;21-Acetyloxy-17-hydroxy-5β-pregnane-3,11,20-trione;Pregnane-3,11,20-trione, 21-(acetyloxy)-17-hydroxy-, (5.beta.)-
IUPAC Name
[2-[(5R,8S,9S,10S,13S,14S,17R)-17-hydroxy-10,13-dimethyl-3,11-dioxo-1,2,4,5,6,7,8,9,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate
Canonical SMILES
CC(=O)OCC(=O)C1(CCC2C1(CC(=O)C3C2CCC4C3(CCC(=O)C4)C)C)O
InChI Key
AZCNJEFLSOQGST-LPEMZKRWSA-N
Boiling Point
556.1ºC at 760mmHg
Flash Point
187.9ºC
Density
1.224g/cm³
EC Number
216-111-4
Exact Mass
404.22000
H-Bond Acceptor
6
H-Bond Donor
1
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