柯子酸 | 23725-05-5

中文名称：柯子酸

英文名称：Chebulic acid

CAS No.：23725-05-5
分子式：C₁₄H₁₂O₁₁ 分子量：356.2385

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名称和标识符

InChIKey：COZMWVAACFYLBI-XJEVXTIOSA-N
Inchi：1S/C14H12O11/c15-5-1-4-7(10(19)9(5)18)8(3(12(20)21)2-6(16)17)11(13(22)23)25-14(4)24/h1,3,8,11,15,18-19H,2H2,(H,16,17)(H,20,21)(H,22,23)/t3-,8-,11-/m0/s1
SMILES：O1C(C2=C([H])C(=C(C(=C2[C@@]([H])([C@@]1([H])C(=O)O[H])[C@@]([H])(C(=O)O[H])C([H])([H])C(=O)O[H])O[H])O[H])O[H])=O

中文别名

英文别名

Butanedioic acid,[(3S,4S)-3-carboxy-3,4-dihydro-5,6,7-trihydroxy-1-oxo-1H-2-benzopyran-4-yl]-,(2S)-
Chebulic acid
(2S)-2-[(3S,4S)-3-carboxy-5,6,7-trihydroxy-1-oxo-3,4-dihydroisochromen-4-yl]butanedioic acid
Butanedioic acid,[(3S,4S)-3-carboxy-3,4-dihydro-5,6,7-trihydroxy-1-oxo-1H-2-benzopyran-4-yl]-,...
CHEBULIC ACID(SH)
(-)-Chebulic acid
4-Isochromansuccinicacid, 3-carboxy-5,6,7-trihydroxy-1-oxo- (8CI)
Butanedioic acid,(3-carboxy-3,4-dihydro-5,6,7-trihydroxy-1-oxo-1H-2-benzopyran-4-yl)-, [3S-[3a,4b(R*)]]-
Chebulic acid (6CI,7CI)
(2S)-[(3S,4S)-3-Carboxy-3,4-dihydro-5,6,7-trihydroxy-1-oxo-1H-2-benzopyran-4-yl]butanedioic acid
Split acid
2-[(3S,4S)-3-Carboxy-5,6,7-trihydroxy-1-oxo-3,4-dihydroisochromen-4-yl]butanedioic acid
(2S)-2-[(3S)-3,4-Dihydro-3alpha-carboxy-5,6,7-trihydroxy-1-oxo-1H-2-benzopyran-4beta-yl]butanedioic acid
YAA72505
Q5089008
(2S)-2-[(3S,4S)-3-carboxy-5,6,7-trihydroxy-1-oxo-isochroman-4-yl]butanedioic acid
(S)-2-((3S,4S)-3-Carboxy-5,6,7-trihydroxy-1-oxoisochroman-4-yl)succinic acid
2-[(3S,4S)-3-Carboxy-5,6,7-trihydroxy-1-oxo-3,4-dih

计算特性

实验特性