Nicotinic acid acyl-beta-D-glucuronide

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Catalog Number
ACM24719731
Product Name
Nicotinic acid acyl-beta-D-glucuronide
Structure
Structure
CAS
24719-73-1
Category
Heterocyclic Organic Compound
Synonyms
24719-73-1, Nicotinic Acid Acyl-|A-D-glucuronide, |A-D-Glucopyranuronic Acid 1-Nicotinate
IUPAC Name
(2R,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(pyridine-3-carbonyloxy)oxane-2-carboxylic acid
Molecular Weight
299.23
Molecular Formula
C12H13NO8
Canonical SMILES
C1=CC(=CN=C1)C(=O)OC2C(C(C(C(O2)C(=O)O)O)O)O
InChI Key
RRZLIYOEGIYOQP-LOLAFCHLSA-N
Boiling Point
581.713ºC at 760 mmHg
Flash Point
305.609ºC
Density
1.676g/cm³
Exact Mass
299.06400
H-Bond Acceptor
9
H-Bond Donor
4
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