65428-74-2 (脱氢甲酚,Dehydrocommersonine)

快速询单

结构式：

脱氢甲酚MOL文件

CAS号：

65428-74-2

中文名称：

脱氢甲酚

英文名称：

Dehydrocommersonine

分子式：

C₅₁H₈₃NO₂₁

分子量：

1046.19883847237

脱氢甲酚(65428-74-2)名称与标识符

名称

英文别名：

Dehydrocommersonine;Q27896873;(3.BETA.)-SOLANID-5-EN-3-YL O-.BETA.-D-GLUCOPYRANOSYL-(1->2)-O-(.BETA.-D-GLUCOPYRANOSYL-(1->3))-O-.BETA.-D-GLUCOPYRANOSYL-(1->4)-.BETA.-D-GALACTOPYRANOSIDE;(3beta)-Solanid-5-en-3-yl o-beta-D-glucopyranosyl-(1->2)-O-(beta-D-glucopyranosyl-(1->3))-o-beta-D-glucopyranosyl-(1->4)-beta-D-galactopyranoside;8ORO1FQM8B;5,6-Didehydrocommersonine;.BETA.-D-GALACTOPYRANOSIDE, (3.BETA.)-SOLANID-5-EN-3-YL O-.BETA.-D-GLUCOPYRANOSYL-(1->2)-O-(.BETA.-D-GLUCOPYRANOSYL-(1->3))-O-.BETA.-D-GLUCOPYRANOSYL-(1->4)-;beta-D-Galactopyranoside, (3beta)-solanid-5-en-3-yl o-beta-D-glucopyranosyl-(1->2)-O-(beta-D-glucopyranosyl-(1->3))-o-beta-D-glucopyranosyl-(1->4)-;Didehydrocommersonine;UNII-8ORO1FQM8B;65428-74-2;

标识符

InChIKey：

PNSNMPAXFQRVOV-LUBYFOPBSA-N

Inchi：

1S/C51H83NO21/c1-20-5-8-27-21(2)33-28(52(27)15-20)14-26-24-7-6-22-13-23(9-11-50(22,3)25(24)10-12-51(26,33)4)66-46-42(65)39(62)43(32(19-56)70-46)71-49-45(73-48-41(64)38(61)35(58)30(17-54)68-48)44(36(59)31(18-55)69-49)72-47-40(63)37(60)34(57)29(16-53)67-47/h6,20-21,23-49,53-65H,5,7-19H2,1-4H3/t20-,21+,23-,24+,25-,26-,27+,28-,29+,30+,31+,32+,33-,34+,35+,36+,37-,38-,39+,40+,41+,42+,43-,44-,45+,46+,47-,48-,49-,50-,51-/m0/s1

SMILES：

O([C@H]1[C@@H]([C@H]([C@H]([C@@H](CO)O1)O[C@H]1[C@@H]([C@H]([C@@H]([C@@H](CO)O1)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@@H](CO)O1)O)O)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@@H](CO)O1)O)O)O)O)O)[C@H]1CC[C@@]2(C)C(C1)=CC[C@@H]1[C@@H]2CC[C@@]2(C)[C@H]1C[C@H]1[C@@H]2[C@H](C)[C@H]2CC[C@H](C)CN12