Vitisin B

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C25H25O12
Molecular Weight	517.4588
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	1

SHOW SMILES / InChI

Structure Search

SMILES

COC1=CC(=CC(OC)=C1O)C2=[O+]C3=C4C(OC=CC4=C2O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)=CC(O)=C3

InChI

InChIKey=ZFFLAEFKTXRRFR-FHBCLOHASA-O

InChI=1S/C25H24O12/c1-32-15-5-10(6-16(33-2)19(15)28)23-24(37-25-22(31)21(30)20(29)17(9-26)36-25)12-3-4-34-13-7-11(27)8-14(35-23)18(12)13/h3-8,17,20-22,25-26,29-31H,9H2,1-2H3,(H-,27,28)/p+1/t17-,20-,21+,22-,25+/m1/s1

HIDE SMILES / InChI

Approval Year

Name

Type

Language

Vitisin B

Common Name

English

VITISIN B (VITIS VINIFERA)

Preferred Name

English

8-Hydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1?4-pyrano[4,3,2-de][1]benzopyran-1-ylium

Systematic Name

English

PYRANO(4,3,2-DE)-1-BENZOPYRYLIUM, 3-(.BETA.-D-GLUCOPYRANOSYLOXY)-8-HYDROXY-2-(4-HYDROXY-3,5-DIMETHOXYPHENYL)-

Systematic Name

English

3-(.BETA.-D-GLUCOPYRANOSYLOXY)-8-HYDROXY-2-(4-HYDROXY-3,5-DIMETHOXYPHENYL)PYRANO(4,3,2-DE)-1-BENZOPYRYLIUM

Systematic Name

English

MALVIDIN-3-GLUCOSIDE-4-VINYL

Systematic Name

English

Code System Code Type Description

CAS

184362-10-5

Created by admin on Wed Apr 02 11:21:43 GMT 2025 , Edited by admin on Wed Apr 02 11:21:43 GMT 2025

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FDA UNII

C3JJ5TC7LJ

Created by admin on Wed Apr 02 11:21:43 GMT 2025 , Edited by admin on Wed Apr 02 11:21:43 GMT 2025

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EPA CompTox

DTXSID301311376

Created by admin on Wed Apr 02 11:21:43 GMT 2025 , Edited by admin on Wed Apr 02 11:21:43 GMT 2025

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WIKIPEDIA

Vitisin B (pyranoanthocyanin)

Created by admin on Wed Apr 02 11:21:43 GMT 2025 , Edited by admin on Wed Apr 02 11:21:43 GMT 2025

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SUBSTANCE RECORD


					C3JJ5TC7LJ

Vitisin B