Pregn-4-en-3-one,11,17,20,21-tetrahydroxy-,(11b,20s)-

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Catalog Number
ACM1719795
Product Name
Pregn-4-en-3-one,11,17,20,21-tetrahydroxy-,(11b,20s)-
Structure
Structure
CAS
1719-79-5
Category
Heterocyclic Organic Compound
Synonyms
REICHSTEIN'S SUBSTANCE 'EPI' 'E';REICHSTEIN'S EPI ''E'';20-ALPHA-DIHYDROCORTISOL;4-PREGNEN-11-BETA, 17,20-ALPHA, 21-TETROL-3-ONE;4-PREGNEN-11BETA,17ALPHA,20ALPHA,21-TETROL-3-ONE;4-pregnene-11B,17A,20A,21-tetrol-3-one;11B,17ALPHA,20ALPHA,21-Tetrahydroxy-4
IUPAC Name
(8S,9S,10R,11S,13S,14S,17R)-17-[(1S)-1,2-dihydroxyethyl]-11,17-dihydroxy-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one
Molecular Weight
364.4758
Molecular Formula
C21H32O5
Canonical SMILES
CC12CCC(=O)CC1CCC3C2C(CC4(C3CCC4(C(=O)CO)O)C)O
InChI Key
AWWCEQOCFFQUKS-FJWDNACWSA-N
Boiling Point
586.6ºC at 760 mmHg
Flash Point
322.6ºC
Density
1.29 g/cm³
Exact Mass
364.22500
H-Bond Acceptor
5
H-Bond Donor
4
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