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2-[[(8S,9R,10S,11S,13S,14S,16R,17R)-9-Fluoro-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-4-yl]sulfanyl]acetic acid

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Catalog Number
ACM131467453
Product Name
2-[[(8S,9R,10S,11S,13S,14S,16R,17R)-9-Fluoro-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-4-yl]sulfanyl]acetic acid
CAS
131467-45-3
Category
Heterocyclic Organic Compound
Synonyms
4-Cmtdm, 4-(Carboxymethylthio)betamethasone, 4-(Carboxymethylthio)dexamethasone, CID63055, (((11beta,16alpha)-9-Fluoro-11,17,21-trihydroxy-16-methyl-3,20-dioxopregn-1,4-dien-4-yl)thio)acetic acid, 131467-45-3, Acetic acid, (((11beta,16alpha)-9-fluoro-11,17,21-trihydroxy-16-methyl-3,20-dioxopregna-1,4-dien-4-yl)thio)-
IUPAC Name
2-[[(8S,9R,10S,11S,13S,14S,16R,17R)-9-fluoro-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-4-yl]sulfanyl]acetic acid
Molecular Weight
482.562 g/mol
Molecular Formula
C24H31FO7S
Canonical SMILES
CC1CC2C3CCC4=C(C(=O)C=CC4(C3(C(CC2(C1(C(=O)CO)O)C)O)F)C)SCC(=O)O
InChI Key
YNWPGLLPEDRZEY-AHAMZHHVSA-N
Boiling Point
700.8ºC at 760mmHg
Flash Point
377.6ºC
Density
1.43g/cm³
Exact Mass
482.17700
H-Bond Acceptor
8
H-Bond Donor
4
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