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Structure

Rosuvastatin acyl-b-D-glucuronide

CAS
503610-44-4
Catalog Number
ACM503610444
Category
Other Products
Molecular Weight
657.665
Molecular Formula
C28H36FN3O12S

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Specification

Synonyms
Rosuvastatin Acyl-|A-D-glucuronide, 503610-44-4, 1-[(3R,5S,6E)-7-[4-(4-Fluorophenyl)-6-(1-methylethyl)-2-[methyl(methylsulfonyl)amino]-5-pyrimidinyl]-3,5-dihydroxy-6-heptenoate] |A-D-Glucopyranuronic Acid
IUPAC Name
(2S,3S,4S,5R,6S)-6-[(E,3R,5S)-7-[4-(4-fluorophenyl)-2-[methyl(methylsulfonyl)amino]-6-propan-2-ylpyrimidin-5-yl]-3,5-dihydroxyhept-6-enoyl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
Canonical SMILES
CC(C)C1=NC(=NC(=C1C=CC(CC(CC(=O)OC2C(C(C(C(O2)C(=O)O)O)O)O)O)O)C3=CC=C(C=C3)F)N(C)S(=O)(=O)C
InChI Key
AWGDNYJLUILGBY-ZYBQEGLCSA-N
Boiling Point
940.343ºC at 760 mmHg
Melting Point
110-116ºC
Flash Point
522.501ºC
Density
1.547g/cm³
Exact Mass
657.20000
H-Bond Acceptor
16
H-Bond Donor
6
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