CHOLAN-24-OIC ACID, 3-AMINO-7,12-DIHYDROXY-, METHYL ESTER, (3BETA,5BETA,7ALPHA,12ALPHA)-

CAS号
135053-62-2
CCD编号
CCD06667483
分子式
C25 H43 N O4
分子量
421.618

基本信息

产品名称: CHOLAN-24-OIC ACID, 3-AMINO-7,12-DIHYDROXY-, METHYL ESTER, (3BETA,5BETA,7ALPHA,12ALPHA)-
CAS: 135053-62-2
英文同义词: CHOLAN-24-OIC ACID, 3-AMINO-7,12-DIHYDROXY-, METHYL ESTER, (3BETA,5BETA,7ALPHA,12ALPHA)-
MDL号: MFCD21608616
氢键受体数量: 5
氢键供体数量: 3
Smile: C[C@H](CCC(=O)OC)[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CC[C@@H](C4)N)C)O)O)C
InChi: InChI=1S/C25H43NO4/c1-14(5-8-22(29)30-4)17-6-7-18-23-19(13-21(28)25(17,18)3)24(2)10-9-16(26)11-15(24)12-20(23)27/h14-21,23,27-28H,5-13,26H2,1-4H3/t14-,15+,16+,17-,18+,19+,20-,21+,23+,24+,25-/m1/s1
InChiKey: InChIKey=AVHAEQZRKMRLKH-RMPHWFMRSA-N

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