CAS
64429-86-3 Purity
96%
64429-86-3 Purity
96%
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Glycine-1-13c,N-[(3a,5b,7a,12a)-3,7,12-trihydroxy-24-oxocholan-24-yl]-
CAS
64431-95-4
Catalog Number
ACM64431954
Category
Other Products
Molecular Weight
466.63
Molecular Formula
C26H43NO6
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Specification
Synonyms
337609_ALDRICH, Glycocholic acid-(glycyl-1-13C) monohydrate, Glycocholic acid-(glycine-1-13C) monohydrate, 64431-95-4
IUPAC Name
2-[[(4R)-4-[(3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoyl]amino]acetic acid;hydrate
Canonical SMILES
CC(CCC(=O)NCC(=O)O)C1CCC2C1(C(CC3C2C(CC4C3(CCC(C4)O)C)O)O)C
InChI Key
WDKPRHOCWKLQPK-TXDHSPGBSA-N
Melting Point
135-140ºC(lit.)
Exact Mass
466.31200
H-Bond Acceptor
7
H-Bond Donor
6
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