267422-86-6 (3,8,12,14-四羟基孕烷-5-烯-20-酮;(3β,12β,14β,17α)-,12-O-(3-吡啶羰基),3-O-[β-D-吡喃葡萄糖基-(1→4) -β-D-油雄吡喃糖基-(1→4) -β-D-洋地黄氧吡喃糖基-(1→4) -β-D-洋地黄氧吡喃糖基-(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-Pyridinecarbonyl), 3-O-[β-D-glucopyranosyl-(1→4)-β-D-oleandropyranosyl-(1→4)-β-D-digitoxopyranosyl-(1→4)-β-D-digitoxopyranosyl-(1→4)-β-D-cymaropyranoside])

CAS号:
267422-86-6
中文名称:
3,8,12,14-四羟基孕烷-5-烯-20-酮;(3β,12β,14β,17α)-,12-O-(3-吡啶羰基),3-O-[β-D-吡喃葡萄糖基-(1→4) -β-D-油雄吡喃糖基-(1→4) -β-D-洋地黄氧吡喃糖基-(1→4) -β-D-洋地黄氧吡喃糖基-(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-Pyridinecarbonyl), 3-O-[β-D-glucopyranosyl-(1→4)-β-D-oleandropyranosyl-(1→4)-β-D-digitoxopyranosyl-(1→4)-β-D-digitoxopyranosyl-(1→4)-β-D-cymaropyranoside]
分子式:
C59H89NO23
分子量:
1180.33088088036
植物源:

3,8,12,14-四羟基孕烷-5-烯-20-酮;(3β,12β,14β,17α)-,12-O-(3-吡啶羰基),3-O-[β-D-吡喃葡萄糖基-(1→4) -β-D-油雄吡喃糖基-(1→4) -β-D-洋地黄氧吡喃糖基-(1→4) -β-D-洋地黄氧吡喃糖基-(1→4) -β-D-吡喃葡萄糖苷](267422-86-6)名称与标识符

标识符

InChIKey:
IQDIAXAEBOLMKZ-UHFFFAOYSA-N
Inchi:
1S/C59H89NO23/c1-27(62)35-14-17-59(70)57(35,7)42(79-54(68)32-11-10-18-60-25-32)24-41-56(6)15-13-34(19-33(56)12-16-58(41,59)69)77-45-22-38(71-8)52(30(4)75-45)82-44-21-37(64)50(28(2)74-44)80-43-20-36(63)51(29(3)73-43)81-46-23-39(72-9)53(31(5)76-46)83-55-49(67)48(66)47(65)40(26-61)78-55/h10-12,18,25,28-31,34-53,55,61,63-67,69-70H,13-17,19-24,26H2,1-9H3
SMILES:
COC1C(OC2OC(C)C(OC3OC(C)C(OC4OC(C)C(OC5C(O)C(O)C(O)C(CO)O5)C(OC)C4)C(O)C3)C(O)C2)C(C)OC(OC2CC3C(C4C(CC=3)(O)C3(C(C(C(=O)C)CC3)(C)C(OC(C3C=NC=CC=3)=O)C4)O)(C)CC2)C1