53078-36-7 (( )

快速询单

结构式：

 MOL文件

CAS号：

53078-36-7

英文名称：

分子式：

C₅₄H₈₈O₂₃

分子量：

1105.26274013519

植物源：

黄花九轮草

 (53078-36-7)名称与标识符

名称

英文别名：

Primulic acid;GALACTOPYRANOSIDURONIC ACID, 16.ALPHA.,28-DIHYDROXYOLEAN-12-EN-3.BETA.-YL O-.BETA.-D-GLUCOPYRANOSYL-(1->6)-O-.BETA.-D-GALACTOPYRANOSYL-(1->4)-O-(.ALPHA.-L-RHAMNOPYRANOSYL-(1->2))-, .BETA.-D-;UNII-9L8V879R7J;4-18-00-05150 (Beilstein Handbook Reference);BRN 0078553;Q27272697;NSC 409073;beta-D-Galactopyranosiduronic acid, (3beta,16alpha)-16,28-dihydroxyolean-12-en-3-yl O-6-deoxy-alpha-L-mannopyranosyl-(1-2)-O-(O-beta-D-glucopyranosyl-(1-6)-beta-D-galactopyranosyl-(1-4))-;Primulasaure;NSC-409073;DTXSID101317780;beta-D-Galactopyranosiduronic acid, (3beta,16alpha)-16,28-dihydroxyolean-12-en-3-yl O-6-deoxy-alpha-L-mannopyranosyl-(1-2)-O-(O-beta-D-glucopyranosyl-(1-6)-beta-D-galactopyranosyl-(1- 4))-;Primulasaure [German];53078-36-7;beta-D-GALACTOPYRANOSIDURONIC ACID, (3beta,16alpha)-16,28-DIHYDROXYOLEAN-12-EN-3-YL O-6-DEOXY-alpha-L-MANNOPYRANOSYL-(1->2)-O-(O-beta-D-GLUCOPYRANOSYL-(1->6)-beta-D-GALACTOPYRANOSYL-(1->4))-;9L8V879R7J;GALACTOPYRANOSIDURONIC ACID, 16alpha,28-DIHYDROXYOLEAN-12-EN-3beta-YL O-beta-D-GLUCOPYRANOSYL-(1->6)-O-beta-D-GALACTOPYRANOSYL-(1->4)-O-(alpha-L-RHAMNOPYRANOSYL-(1->2))-, beta-D-;.BETA.-D-GALACTOPYRANOSIDURONIC ACID, (3.BETA.,16.ALPHA.)-16,28-DIHYDROXYOLEAN-12-EN-3-YL O-6-DEOXY-.ALPHA.-L-MANNOPYRANOSYL-(1->2)-O-(O-.BETA.-D-GLUCOPYRANOSYL-(1->6)-.BETA.-D-GALACTOPYRANOSYL-(1->4))-;NSC409073;4-hydroxy-6-[[8-hydroxy-8a-(hydroxymethyl)-4,4,6a,6b,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-5-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy-3-[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxyoxane-2-carboxylic acid;.beta.-D-Galactopyranosiduronic acid,16.alpha.)-16,28-dihydroxyolean-12-en-3-yl O-6-deoxy-.alpha.-L-mannopyranosyl-(1.fwdarw.2)-O-[O-.beta.-D-glucopyranosyl-(1.fwdarw.6)-.beta.-D-galactopyranosyl-(1.fwdarw.4)]-;

标识符

InChIKey：

LDPKDIVFHXKSCE-JEJIYGHQSA-N

Inchi：

1S/C54H88O23/c1-22-31(58)34(61)38(65)46(71-22)76-42-40(67)41(75-47-39(66)36(63)33(60)26(73-47)20-70-45-37(64)35(62)32(59)25(19-55)72-45)43(44(68)69)77-48(42)74-30-12-13-51(6)27(50(30,4)5)11-14-52(7)28(51)10-9-23-24-17-49(2,3)15-16-54(24,21-56)29(57)18-53(23,52)8/h9,22,24-43,45-48,55-67H,10-21H2,1-8H3,(H,68,69)/t22-,24-,25+,26+,27-,28+,29+,30-,31-,32+,33-,34+,35-,36-,37?,38+,39+,40-,41+,42+,43-,45+,46-,47-,48+,51-,52+,53+,54+/m0/s1

SMILES：

O([C@H]1[C@@H]([C@H]([C@H]([C@@H](C(=O)O)O1)O[C@H]1[C@@H]([C@H]([C@H]([C@@H](CO[C@H]2C([C@H]([C@@H]([C@@H](CO)O2)O)O)O)O1)O)O)O)O)O[C@H]1[C@@H]([C@@H]([C@H]([C@H](C)O1)O)O)O)[C@H]1CC[C@@]2(C)[C@H](C1(C)C)CC[C@@]1(C)[C@]3(C)C[C@H]([C@@]4(CO)CCC(C)(C)C[C@H]4C3=CC[C@@H]12)O