2α,3β,19α,23-四羟基-12-烯-28-酸28-O-β-D-吡喃葡萄糖苷(105706-14-7)名称与标识符
名称
英文别名:
2alpha,3beta,19alpha,23-tetrahydroxyurs-12-en-28-oic acid 28-O-beta-D-glucopyranoside;CMF;Nigaichigoside F1;niga-ichigoside F1;(+)-Niga-ichigoside F1;2alpha,3alpha,19alpha,24-Tetrahydroxyurs-12-en-28-oic acid 28-O-beta-D-glucopyranosyl ester;(20S)-niga-ichigoside F1;ConMedNP.819;(-)-4-Epi-niga-ichigoside F1;
标识符
InChIKey:
WKKBYJLXSKPKSC-UHFFFAOYSA-N
Inchi:
1S/C36H58O11/c1-18-9-12-36(30(44)47-29-26(42)25(41)24(40)21(16-37)46-29)14-13-33(4)19(27(36)35(18,6)45)7-8-23-31(2)15-20(39)28(43)32(3,17-38)22(31)10-11-34(23,33)5/h7,18,20-29,37-43,45H,8-17H2,1-6H3
SMILES:
CC1C(O)(C)C2C(C(OC3C(O)C(O)C(O)C(CO)O3)=O)(CCC3(C4(C(C5(C(CC4)C(CO)(C)C(O)C(O)C5)C)CC=C32)C)C)CC1