948046-18-2 (((3β,6α,12β,20ξ)-3,12,20,25-Tetrahydroxydammaran-6-yl 2-O-β-D-xylopyranosyl-β-D-glucopyranoside)

快速询单

结构式：

(3β,6α,12β,20ξ)-3,12,20,25-Tetrahydroxydammaran-6-yl 2-O-β-D-xylopyranosyl-β-D-glucopyranosideMOL文件

CAS号：

948046-18-2

英文名称：

(3β,6α,12β,20ξ)-3,12,20,25-Tetrahydroxydammaran-6-yl 2-O-β-D-xylopyranosyl-β-D-glucopyranoside

分子式：

C₄₁H₇₂O₁₄

分子量：

789.00199508667

(3β,6α,12β,20ξ)-3,12,20,25-Tetrahydroxydammaran-6-yl 2-O-β-D-xylopyranosyl-β-D-glucopyranoside(948046-18-2)名称与标识符

名称

英文别名：

(3β,6α,12β,20ξ)-3,12,20,25-Tetrahydroxydammaran-6-yl 2-O-β-D-xylopyranosyl-β-D-glucopyranoside;

标识符

InChIKey：

HUOVMMNSYYQLMQ-VZCBNOEQSA-N

Inchi：

1S/C41H72O14/c1-36(2,50)12-9-13-41(8,51)20-10-15-39(6)27(20)21(43)16-25-38(5)14-11-26(45)37(3,4)33(38)23(17-40(25,39)7)53-35-32(30(48)29(47)24(18-42)54-35)55-34-31(49)28(46)22(44)19-52-34/h20-35,42-51H,9-19H2,1-8H3/t20-,21-,22+,23+,24+,25+,26+,27-,28-,29+,30-,31+,32+,33?,34-,35+,38+,39+,40+,41?/m0/s1

SMILES：

O([C@@H]1C[C@@]2([C@@]([H])([C@]3(C)C1[C@](C)(C)[C@H](O)CC3)C[C@H](O)[C@@]1([H])[C@]2(CC[C@@H]1C(O)(C)CCCC(O)(C)C)C)C)[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O[C@@H]1OC[C@@H](O)[C@H](O)[C@H]1O

(3β,6α,12β,20ξ)-3,12,20,25-Tetrahydroxydammaran-6-yl 2-O-β-D-xylopyranosyl-β-D-glucopyranoside(948046-18-2)物化性质

实验特性

沸点 : 913.9±65.0 °C(Predicted)
酸度系数(pKa) : 12.85±0.70(Predicted)
密度 : 1.33±0.1 g/cm3(Temp: 20 °C; Press: 760 Torr)(Predicted)

(3β,6α,12β,20ξ)-3,12,20,25-Tetrahydroxydammaran-6-yl 2-O-β-D-xylopyranosyl-β-D-glucopyranoside(948046-18-2)合成路线

合成路线：1 步

反应条件：

1.1 Solvents: Ethanol , Water ; 4 d, 26 °C

参考文献：

Microbial Transformation of 20(S)-Protopanaxatriol-Type Saponins by Absidia coerulea

Chen, Guangtong; Yang, Min; Lu, Zhiqiang; Zhang, Jinqiang; Huang, Huilian; et al, Journal of Natural Products, 2007, 70(7), 1203-1206

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948046-18-2 (((3β,6α,12β,20ξ)-3,12,20,25-Tetrahydroxydammaran-6-yl 2-O-β-D-xylopyranosyl-β-D-glucopyranoside)

(3β,6α,12β,20ξ)-3,12,20,25-Tetrahydroxydammaran-6-yl 2-O-β-D-xylopyranosyl-β-D-glucopyranoside(948046-18-2)名称与标识符

名称

标识符

(3β,6α,12β,20ξ)-3,12,20,25-Tetrahydroxydammaran-6-yl 2-O-β-D-xylopyranosyl-β-D-glucopyranoside(948046-18-2)物化性质

实验特性

(3β,6α,12β,20ξ)-3,12,20,25-Tetrahydroxydammaran-6-yl 2-O-β-D-xylopyranosyl-β-D-glucopyranoside(948046-18-2)合成路线

目录