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Structure

4-Pregnen-17,20α,21-triol-3-one

CAS
3946-10-9
Catalog Number
ACM3946109
Category
Steroidal Compounds
Molecular Weight
348.48
Molecular Formula
C21H32O4

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Specification

Synonyms
17,20,21-Trihydroxypregn-4-en-3-one; 17,20,21-Trihydroxy-4-pregnen-3-one; 17,20,21-THP; 20-Dihydro-11-deoxycortisol; 20-Dihydro Cortexolone;
IUPAC Name
(8R,9S,10R,13S,14S,17R)-17-[(1S)-1,2-dihydroxyethyl]-17-hydroxy-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one
Canonical SMILES
CC12CCC(=O)C=C1CCC3C2CCC4(C3CCC4(C(CO)O)O)C
InChI Key
XNFSGLNHLVHCFT-MQWPULPWSA-N
Boiling Point
544.4ºC at 760 mmHg
Flash Point
297.1ºC
Density
1.22g/cm³
EC Number
223-536-9
Exact Mass
348.23000
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