26563-58-6 ((Glycine, N-[N-[(3α,5β,7α,12α)-3,7,12-trihydroxy-24-oxocholan-24-yl]glycyl]- (9CI))

CAS号:
26563-58-6
英文名称:
Glycine, N-[N-[(3α,5β,7α,12α)-3,7,12-trihydroxy-24-oxocholan-24-yl]glycyl]- (9CI)
分子式:
C28H46N2O7
分子量:
522.674048900604

Glycine, N-[N-[(3α,5β,7α,12α)-3,7,12-trihydroxy-24-oxocholan-24-yl]glycyl]- (9CI)(26563-58-6)名称与标识符

名称

英文别名:
Glycine, N-[N-[(3α,5β,7α,12α)-3,7,12-trihydroxy-24-oxocholan-24-yl]glycyl]- (9CI);Cholane, glycine deriv. (ZCI);Glycine, N-(N-choloylglycyl)- (8CI);Cholyldiglycine;Glycylglycocholic acid;

标识符

InChIKey:
HAYYIOAHIPQKBA-NLLMDGPUSA-N
Inchi:
1S/C28H46N2O7/c1-15(4-7-23(34)29-13-24(35)30-14-25(36)37)18-5-6-19-26-20(12-22(33)28(18,19)3)27(2)9-8-17(31)10-16(27)11-21(26)32/h15-22,26,31-33H,4-14H2,1-3H3,(H,29,34)(H,30,35)(H,36,37)/t15-,16+,17-,18-,19+,20+,21-,22+,26+,27+,28-/m1/s1
SMILES:
O[C@@H]1C[C@@H]2C[C@@H](CC[C@]2(C)[C@@H]2[C@@H]1[C@@H]1CC[C@H]([C@H](C)CCC(=O)NCC(=O)NCC(=O)O)[C@]1([C@H](C2)O)C)O

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