645396-28-7 (3,8,12,14-四羟基孕烷-5-烯-20-酮;(3β,12β,14β,17α)-,12-O-(3,4-二甲基-2-戊烯酰基),3-O-[β-D-吡喃酮基-(1→4) -β-D-氰基吡喃糖基-(1→4) -β-D-氰基吡喃糖基-(1→4) -β-D-吡喃葡萄糖苷],3,8,12,14-Tetrahydroxypregn-5-en-20-one; (3β,12β,14β,17α)-form, 12-O-(3,4-Dimethyl-2-pentenoyl), 3-O-[β-D-thevetopyranosyl-(1→4)-β-D-cymaropyranosyl-(1→4)-β-D-cymaropyranosyl-(1→4)-β-D-cymaropyranoside])

CAS号:
645396-28-7
中文名称:
3,8,12,14-四羟基孕烷-5-烯-20-酮;(3β,12β,14β,17α)-,12-O-(3,4-二甲基-2-戊烯酰基),3-O-[β-D-吡喃酮基-(1→4) -β-D-氰基吡喃糖基-(1→4) -β-D-氰基吡喃糖基-(1→4) -β-D-吡喃葡萄糖苷]
英文名称:
3,8,12,14-Tetrahydroxypregn-5-en-20-one; (3β,12β,14β,17α)-form, 12-O-(3,4-Dimethyl-2-pentenoyl), 3-O-[β-D-thevetopyranosyl-(1→4)-β-D-cymaropyranosyl-(1→4)-β-D-cymaropyranosyl-(1→4)-β-D-cymaropyranoside]
分子式:
C56H90O19
分子量:
1067.30242013931

3,8,12,14-四羟基孕烷-5-烯-20-酮;(3β,12β,14β,17α)-,12-O-(3,4-二甲基-2-戊烯酰基),3-O-[β-D-吡喃酮基-(1→4) -β-D-氰基吡喃糖基-(1→4) -β-D-氰基吡喃糖基-(1→4) -β-D-吡喃葡萄糖苷](645396-28-7)名称与标识符

标识符

InChIKey:
AYXWWRAVVDSOLC-UHFFFAOYSA-N
Inchi:
1S/C56H90O19/c1-27(2)28(3)21-42(58)72-41-26-40-53(9)18-16-35(22-34(53)15-19-55(40,61)56(62)20-17-36(29(4)57)54(41,56)10)71-43-23-37(63-11)48(31(6)67-43)73-44-24-38(64-12)49(32(7)68-44)74-45-25-39(65-13)50(33(8)69-45)75-52-47(60)51(66-14)46(59)30(5)70-52/h15,21,27,30-33,35-41,43-52,59-62H,16-20,22-26H2,1-14H3
SMILES:
COC1C(OC2OC(C)C(OC3OC(C)C(OC4C(O)C(OC)C(O)C(C)O4)C(OC)C3)C(OC)C2)C(C)OC(OC2CC3C(C4C(CC=3)(O)C3(C(C(C(=O)C)CC3)(C)C(OC(C=C(C(C)C)C)=O)C4)O)(C)CC2)C1