133740-15-5 (euojaponine C,euojaponine C)

快速询单

结构式：

euojaponine CMOL文件

CAS号：

133740-15-5

中文名称：

euojaponine C

英文名称：

euojaponine C

分子式：

C₄₆H₄₉NO₁₇

分子量：

887.877774953842

euojaponine C(133740-15-5)名称与标识符

名称

英文别名：

euojaponine C;(1S,3R,13S,14S,17S,18S,19R,20S,21S,22S,23R,24S,25R)-21,22-Bis(acetyloxy)-20-[(acetyloxy)methyl]-19-(benzoyloxy)-18,25-dihydroxy-3,13,14,25-tetramethyl-6,15-dioxo-2,5,16-trioxa-11-azapentacyclo[15.7.1.0,.0,.0,]pentacosa-7(12),8,10-trien-24-yl benzoic acid;[(1S,3R,13S,14S,17S,18R,19R,20S,21S,22R,23R,24R,25S)-21,22-diacetyloxy-20-(acetyloxymethyl)-19-benzoyloxy-18,25-dihydroxy-3,13,14,25-tetramethyl-6,15-dioxo-2,5,16-trioxa-11-azapentacyclo[15.7.1.01,20.03,23.07,12]pentacosa-7(12),8,10-trien-24-yl] benzoate;((1S,3R,13S,14S,17S,18R,19R,20S,21S,22R,23R,24R,25S)-21,22-diacetyloxy-20-(acetyloxymethyl)-19-benzoyloxy-18,25-dihydroxy-3,13,14,25-tetramethyl-6,15-dioxo-2,5,16-trioxa-11-azapentacyclo(15.7.1.01,20.03,23.07,12)pentacosa-7(12),8,10-trien-24-yl) benzoate;(1S,3R,13S,14S,17S,18S,19R,20S,21S,22S,23R,24S,25R)-21,22-Bis(acetyloxy)-20-((acetyloxy)methyl)-19-(benzoyloxy)-18,25-dihydroxy-3,13,14,25-tetramethyl-6,15-dioxo-2,5,16-trioxa-11-azapentacyclo(15.7.1.0,.0,.0,)pentacosa-7(12),8,10-trien-24-yl benzoic acid;CHEMBL509081;133740-15-5;

标识符

InChIKey：

HHFVGDDLOBPLQQ-UHFFFAOYSA-N

Inchi：

1S/C46H49NO17/c1-23-24(2)39(52)62-36-33(51)37(63-41(54)29-17-12-9-13-18-29)45(22-57-25(3)48)38(60-27(5)50)34(59-26(4)49)31-35(61-40(53)28-15-10-8-11-16-28)46(45,44(36,7)56)64-43(31,6)21-58-42(55)30-19-14-20-47-32(23)30/h8-20,23-24,31,33-38,51,56H,21-22H2,1-7H3

SMILES：

CC1C2C(=CC=CN=2)C(=O)OCC2(C3C(C4(C(C(C3OC(=O)C)OC(=O)C)(COC(=O)C)C(OC(C3C=CC=CC=3)=O)C(O)C(C4(O)C)OC(=O)C1C)O2)OC(C1C=CC=CC=1)=O)C