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Structure

6Alpha-fluoro-11beta,17,21-trihydroxy-16alpha-methylpregn-4-ene-3,20-dione

CAS
387-59-7
Catalog Number
ACM387597
Category
Other Products
Molecular Weight
394.477 g/mol
Molecular Formula
C22H31FO5

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Specification

Synonyms
EINECS 206-861-0, CID9799, 6alpha-Fluoro-11beta,17,21-trihydroxy-16alpha-methylpregn-4-ene-3,20-dione, 387-59-7
IUPAC Name
(6S,16R,17R)-6-fluoro-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13,16-trimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one
Canonical SMILES
CC1CC2C3CC(C4=CC(=O)CCC4(C3C(CC2(C1(C(=O)CO)O)C)O)C)F
InChI Key
JXOONFORBFAKIN-KTTHZPTNSA-N
Boiling Point
569.9ºC at 760mmHg
Flash Point
298.4ºC
Density
1.29g/cm³
EC Number
206-861-0
Exact Mass
394.21600
H-Bond Acceptor
6
H-Bond Donor
3
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