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Structure

(S)-Carisbamate β-D-O-glucuronide

CAS
940279-82-3
Catalog Number
ACM940279823
Category
Other Products
Molecular Weight
391.76
Molecular Formula
C15H18ClNO9

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Specification

Synonyms
(1S)-2-[(Aminocarbonyl)oxy]-1-(2-chlorophenyl)ethyl β-D-Glucopyranosiduronic Acid;
IUPAC Name
(2S,3S,4S,5R,6R)-6-[(1S)-2-carbamoyloxy-1-(2-chlorophenyl)ethoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
Canonical SMILES
C1=CC=C(C(=C1)C(COC(=O)N)OC2C(C(C(C(O2)C(=O)O)O)O)O)Cl
InChI Key
RKWAMNXFHLRQGF-CBIHJVFNSA-N
Boiling Point
706.0±60.0 °C (760 mmHg)
Density
1.63±0.1 g/cm³ (20 °C, 760 mmHg)
Exact Mass
391.06700
H-Bond Acceptor
9
H-Bond Donor
5
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