CAS
70007-83-9 Purity
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70007-83-9 Purity
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Tetraethylammonium(5beta)-3alpha,7alpha,12alpha)-trihydroxycholan-24-oate
CAS
70008-57-0
Catalog Number
ACM70008570
Category
Other Products
Molecular Weight
537.814560 [g/mol]
Molecular Formula
C24H39O5.C8H20N
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Specification
Synonyms
EINECS 274-253-2, Tetraethylammonium ((5beta)-3alpha,7alpha,12alpha)-trihydroxycholan-24-oate, 70008-57-0
IUPAC Name
tetraethylazanium; (4R)-4-[(5R,10S,13R,17R)-2,3,3-trihydroxy-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoate
Canonical SMILES
CC[N+](CC)(CC)CC.CC(CCC(=O)[O-])C1CCC2C1(CCC3C2CCC4C3(CC(C(C4)(O)O)O)C)C
InChI Key
KIHDCQQFWYWCDR-VARYBCSTSA-M
EC Number
274-253-2
Exact Mass
537.43900
H-Bond Acceptor
5
H-Bond Donor
3
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