9,17-Dibromo-11beta,21-dihydroxy-16alpha-methylpregna-1,4-diene-3,20-dione

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Catalog Number
ACM61339422
Product Name
9,17-Dibromo-11beta,21-dihydroxy-16alpha-methylpregna-1,4-diene-3,20-dione
CAS
61339-42-2
Category
Heterocyclic Organic Compound
Synonyms
EINECS 262-722-4, CID6454164, 9,17-Dibromo-11beta,21-dihydroxy-16alpha-methylpregna-1,4-diene-3,20-dione, 61339-42-2
IUPAC Name
(8S,10S,11S,13S,14S,16R,17R)-9,17-dibromo-11-hydroxy-17-(2-hydroxyacetyl)-10,13,16-trimethyl-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-3-one
Molecular Weight
516.263320 [g/mol]
Molecular Formula
C22H28Br2O4
Canonical SMILES
CC1CC2C3CCC4=CC(=O)C=CC4(C3(C(CC2(C1(C(=O)CO)Br)C)O)Br)C
InChI Key
ABWOTFZUTTYNAA-VBCPKWTRSA-N
EC Number
262-722-4
Exact Mass
514.03500
H-Bond Acceptor
4
H-Bond Donor
2
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