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Structure

Betamethasone b-D-glucuronide

CAS
744161-79-3
Catalog Number
ACM744161793
Category
Other Products
Molecular Weight
568.59
Molecular Formula
C28H37FO11

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Specification

Synonyms
Betamethasone |A-D-Glucuronide, (11|A,16|A)-9-Fluoro-11,17-dihydroxy-16-methyl-3,20-dioxopregna-1,4-dien-21-yl |A-D-Glucopyranosiduronic Acid, 744161-79-3
IUPAC Name
(2R,3R,4R,5S,6S)-6-[2-[(8S,9R,10S,11S,13S,14S,16S,17R)-9-fluoro-11,17-dihydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
Canonical SMILES
CC1CC2C3CCC4=CC(=O)C=CC4(C3(C(CC2(C1(C(=O)COC5C(C(C(C(O5)C(=O)O)O)O)O)O)C)O)F)C
InChI Key
UBHXMSIBGRGDSX-SRABRGTMSA-N
Boiling Point
816.033ºC at 760 mmHg
Flash Point
447.321ºC
Density
1.506g/cm³
Exact Mass
568.23200
H-Bond Acceptor
12
H-Bond Donor
6
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