5-(2-Hydroxyethoxy)-2-(3-hydroxy-4-methoxyphenyl)-4-oxo-4H-chromen-7-yl 6-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranoside（CAS番号：115960-14-0）

5-(2-Hydroxyethoxy)-2-(3-hydroxy-4-methoxyphenyl)-4-oxo-4H-chromen-7-yl 6-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranoside

基本情報

編集器で閲覧

CAS番号

115960-14-0

分子式

C30H36O16

分子量

652.6 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

沸点

962.7°C at 760 mmHg

引火点

311.1°C

屈折率

1.689

SMILES

編集器で閲覧

CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=CC4=C(C(=C3)OCCO)C(=O)C=C(O4)C5=CC(=C(C=C5)OC)O)O)O)O)O)O)O

InChI

InChI=1S/C30H36O16/c1-12-23(34)25(36)27(38)29(43-12)42-11-21-24(35)26(37)28(39)30(46-21)44-14-8-19(41-6-5-31)22-16(33)10-18(45-20(22)9-14)13-3-4-17(40-2)15(32)7-13/h3-4,7-10,12,21,23-32,34-39H,5-6,11H2,1-2H3/t12-,21+,23-,24+,25+,26-,27+,28+,29+,30+/m0/s1

InChIKey

XYFLWVOTXWXNAM-WTNNCJBMSA-N

LogP

-1.4241999999999995

トポロジカル極性表面積

247.42999999999995 Å²

水素結合ドナー/アクセプター

8 / 16

複雑度

1040

同義語と引用データ

英語

115960-14-0
F-117
DTXSID90151237
O-(beta-Hydroxyethyl)diosmin
F 117
O-(6-DEOXY-.ALPHA.-L-MANNOPYRANOSYL)-.BETA.-D-GLUCOPYRANOSYL)OXY)-5-(2-HYDROXYETHOXY)-2-(3-HYDROXY-4-METHOXYPHENYL)-
4I5K8199OQ
CHEBI:135840
5-o-(.beta.-hydroxyethyl)diosmin
Hidiosmin
Hidrosmin
UNII-4I5K8199OQ
SCHEMBL21074303
Venosmil
DB13490
5-(2-hydroxyethoxy)-2-(3-hydroxy-4-methoxyphenyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one
4H-1-Benzopyran-4-one, 7-((6-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl)oxy)-5-(2-hydroxyethoxy)-2-(3-hydroxy-4-methoxyphenyl)-
AKOS015896509
Q5752914
CHEMBL3707286
HIDROSMIN [WHO-DD]
4H-1-Benzopyran-4-one,7-[[6-O-(6-deoxy-a-L-mannopyranosyl)-b-D-glucopyranosyl]oxy]-5-(2-hydroxyethoxy)-2-(3-hydroxy-4-methoxyphenyl)-
4H-1-Benzopyran-4-one,7-[[6-O-(6-deoxy-a-L-mannopyranosyl)-b-D-glucopyranosyl]oxy]-5-(2-hydrox...
4H-1-Benzopyran-4-one,7-[[6-O-(6-deoxy-a-L-mannopyranosyl)-b-D-glucopyranosyl]oxy]-5-(2-hydroxyethoxy)-2-(3-hydroxy-4-methoxy
5-(2-hydroxyethoxy)-2-(3-hydroxy-4-methoxyphenyl)-4-oxo-4H-chromen-7-yl 6-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranoside
5-O-(beta-Hydroxyethyl)diosmin
7-[[6-O-(6-Deoxy-a-L-mannopyranosyl)-β-D-glucopyranosyl]oxy]-3,5-di-O-hydroxyethyl-2-(3-hydroxy-4-methoxyphenyl)-4H-1-Benzopyran-4-one
7-[[6-O-(6-Deoxy-a-L-mannopyranosyl)-β-D-glucopyranosyl]oxy]-5-hydroxy-2-(3'-mono-O-hydroxyethyl-4'-methoxyphenyl)-4H-1-Benzopyran-4-one
5-(2-hydroxyethoxy)-2-(3-hydroxy-4-methoxyphenyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[ [(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one