Gallenacid

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Catalog Number
ACM142974514
Product Name
Gallenacid
CAS
142974-51-4
Category
Heterocyclic Organic Compound
Synonyms
CID213038, S 0960, 142974-51-4, Cholan-24-oic acid, 7,12-dihydroxy-3-(((3alpha,5beta,7alpha,12alpha)-3,7,12-trihydroxy-24-oxocholan-24-yl)amino)-, (3beta,5beta,7alpha,12alpha)-
IUPAC Name
(4R)-4-[(3S,5S,7R,8R,9S,10S,12S,13R,14S,17R)-7,12-dihydroxy-10,13-dimethyl-3-[[(4R)-4-[(3S,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
Molecular Weight
798.142760 [g/mol]
Molecular Formula
C48H79NO8
Canonical SMILES
CC(CCC(=O)NC1CCC2(C(C1)CC(C3C2CC(C4(C3CCC4C(C)CCC(=O)O)C)O)O)C)C5CCC6C5(C(CC7C6C(CC8C7(CCC(C8)O)C)O)O)C
InChI Key
GCJPHGQNZBNLBM-LBAUJTLSSA-N
H-Bond Acceptor
8
H-Bond Donor
7
MSDS
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COA
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Spec Sheet
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