6Beta,9-difluoro-11beta,16alpha,17,21-tetrahydroxypregna-1,4-diene-3,20-dione 16,21-di(acetate)

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Catalog Number
ACM60864495
Product Name
6Beta,9-difluoro-11beta,16alpha,17,21-tetrahydroxypregna-1,4-diene-3,20-dione 16,21-di(acetate)
Structure
Structure
CAS
60864-49-5
Category
Heterocyclic Organic Compound
Synonyms
EINECS 262-489-9, CID6454065, 60864-49-5, 6beta,9-Difluoro-11beta,16alpha,17,21-tetrahydroxypregna-1,4-diene-3,20-dione 16,21-di(acetate)
IUPAC Name
4-[(6R,8S,10S,11S,13S,14S,16S,17S)-16-(carboxymethyl)-6,9-difluoro-11,16,17-trihydroxy-10,13-dimethyl-3-oxo-7,8,11,12,14,15-hexahydro-6H-cyclopenta[a]phenanthren-17-yl]-3-hydroxy-4-oxobutanoic acid
Molecular Weight
528.496506 [g/mol]
Molecular Formula
C25H30F2O8
Canonical SMILES
CC12CC(C3(C(C1CC(C2(C(=O)C(CC(=O)O)O)O)(CC(=O)O)O)CC(C4=CC(=O)C=CC43C)F)F)O
InChI Key
HADBRQWKADXKGS-FPCKIHMMSA-N
EC Number
262-489-9
Exact Mass
528.18100
H-Bond Acceptor
12
H-Bond Donor
6
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