[6-[2-(3,4-dihydroxyphenyl)ethoxy]-5-hydroxy-4-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy-2-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxymethyl]oxan-3-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate（CAS番号：94079-81-9）

[6-[2-(3,4-dihydroxyphenyl)ethoxy]-5-hydroxy-4-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy-2-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxymethyl]oxan-3-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate

基本情報

編集器で閲覧

CAS番号

94079-81-9

分子式

C35H46O19

分子量

770.73 g/mol

化学分類

基礎化学原料有機化学品カルボン酸類

基礎化学原料有機化学品エステル類

基礎化学原料有機化学品エーテル類

基礎化学原料有機化学品複素環化合物

医薬化学品医薬中間体複素環中間体

精密化学品染料および顔料有機染料

精密化学品界面活性剤アニオン性界面活性剤

実験室化学品研究用化学品生化学試薬

基本的な物理特性

物理状態

Powder

密度

1.62

溶解度

Methanol,Water,DMSO

SMILES

編集器で閲覧

CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OCCC3=CC(=C(C=C3)O)O)O)OC4C(C(C(C(O4)C)O)O)O)OC(=O)C=CC5=CC(=C(C=C5)O)O)O)O)O

InChI

InChI=1S/C35H46O19/c1-14-24(41)26(43)28(45)33(50-14)49-13-22-31(53-23(40)8-5-16-3-6-18(36)20(38)11-16)32(54-35-29(46)27(44)25(42)15(2)51-35)30(47)34(52-22)48-10-9-17-4-7-19(37)21(39)12-17/h3-8,11-12,14-15,22,24-39,41-47H,9-10,13H2,1-2H3/b8-5+/t14-,15-,22+,24-,25-,26+,27+,28+,29+,30+,31+,32+,33+,34+,35-/m0/s1

InChIKey

YMWRMAOPKNYHMZ-LLVTZOIGSA-N

LogP

-2.164099999999991

トポロジカル極性表面積

304.21 Å²

水素結合ドナー/アクセプター

11 / 19

複雑度

1210

安全情報

安全情報を表示

保管条件

2-8℃

同義語と引用データ

英語

Poliumoside
[6-[2-(3,4-dihydroxyphenyl)ethoxy]-5-hydroxy-4-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy-2-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxymethyl]oxan-3-yl] (e)-3-(3,4-dihydroxyphenyl)prop-2-enoate
2-(1H-TETRAZOL-1-YL)ISONICOTINIC ACID
Y0162
O-6-Deoxy-alpha-L-mannopyranosyl-(1-3)-O-[6-deoxy-alpha-L-mannopyranosyl-(1-6)]-beta-D-glucopyranoside 2-(3,4-dihydroxyphenyl)ethyl 4-[3-(3,4-dihydroxyphenyl)-2-propenoate]
N2499
[(2R,3R,4R,5R,6R)-6-[2-(3,4-Dihydroxyphenyl)ethoxy]-5-hydroxy-4-[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6
CHEBI:183949
HY-N0033
AKOS037647890
6-[2-(3,4-DIHYDROXYPHENYL)ETHOXY]-5-HYDROXY-4-[(3,4,5-TRIHYDROXY-6-METHYLOXAN-2-YL)OXY]-2-{[(3,4,5-TRIHYDROXY-6-METHYLOXAN-2-YL)OXY]METHYL}OXAN-3-YL (2E)-3-(3,4-DIHYDROXYPHENYL)PROP-2-ENOATE
94079-81-9
POLIUMOSIDE
[6-[2-(3,4-dihydroxyphenyl)ethoxy]-5-hydroxy-4-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy-2-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxymethyl]oxan-3-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate
SCHEMBL14917092
2-(3,4-DIHYDROXYPHENYL)ETHYL 3-O,6-O-BIS(ALPHA-L-RHAMNOPYRANOSYL)-4-O-[(E)-3-(3,4-DIHYDROXYPHENYL)PROPENOYL]-BETA-D-GLUCOPYRANOSIDE
AS-75175
AC-34320
CID 6442411