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4-Pregnene-17α,20β,21-triol-3,11-dione

CAS
116-59-6
Catalog Number
ACM116596
Category
Steroidal Compounds
Molecular Weight
362.46
Molecular Formula
C21H30O5

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Specification

Synonyms
116-59-6, Reichsteins substance U, 20|A-Dihydrocortisone, 20beta-Dihydrocortisone, 20beta-Hydroxycortisone, 4-Pregnene-17alpha,20beta,21-triol-3,11-dione, UNII-T35G4D30OP, 4-Pregnene-17|A,20|A,21-triol-3,11-dione, Reichstein inverted exclamation mark s substance U, 17|A,20|A,21-Trihydroxy-4-pregnene-3,11-dione, 4-Pregnene-17alpha,20beta,21-triol-3,11-dione [MI], 17,20,21-Trihydroxypregn-4-ene-3,11-dione, (20R)-, Pregn-4-en-3,11-dione, 17,20,21-trihydroxy-, (20R)-
IUPAC Name
(8S,9S,10R,13S,14S,17R)-17-[(1R)-1,2-dihydroxyethyl]-17-hydroxy-10,13-dimethyl-1,2,6,7,8,9,12,14,15,16-decahydrocyclopenta[a]phenanthrene-3,11-dione
Canonical SMILES
CC12CCC(=O)C=C1CCC3C2C(=O)CC4(C3CCC4(C(CO)O)O)C
InChI Key
XBIDABJJGYNJTK-GNIMZFFESA-N
Exact Mass
362.20900
H-Bond Acceptor
5
H-Bond Donor
3
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