Structure

Carbenoxolone

CAS
5697-56-3
Catalog Number
ACM5697563
Category
Other Products
Molecular Weight
570.76
Molecular Formula
C34H50O7

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Specification

Synonyms
3-beta-(3-carboxypropionyloxy)-11-oxo-olean-12-en-30-oicacid;3-beta-hydroxy-11-oxo-olean-12-en-30-oicacihydrogensuccinate;biogastrone;bioral;CARBENOXOLONE;glycyrrhetinic acid hydrogen succinate;3beta-Hydroxy-11-oxoolean-12-en-30-oic acid hydrogen succina
IUPAC Name
(2S,4aS,6aR,6aS,6bR,8aR,10S,12aS,14bR)-10-(4-hydroxy-4-oxobutanoyl)oxy-2,4a,6a,6b,9,9,12a-heptamethyl-13-oxo-3,4,5,6,6a,7,8,8a,10,11,12,14b-dodecahydro-1H-picene-2-carboxylic acid
Canonical SMILES
CC1(C2CCC3(C(C2(CCC1OC(=O)CCC(=O)O)C)C(=O)C=C4C3(CCC5(C4CC(CC5)(C)C(=O)O)C)C)C)C
InChI Key
OBZHEBDUNPOCJG-WBXJDKIVSA-N
Boiling Point
687.4ºC at 760 mmHg
Melting Point
291-294ºC
Flash Point
211.6ºC
Density
1.2
Appearance
White crystalline powder
EC Number
227-174-2
Exact Mass
570.35600
Hazard Statements
Xi
H-Bond Acceptor
7
H-Bond Donor
2
Safety Description
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
S37/39:Wear suitable gloves and eye/face protection .
WGK Germany
3
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