QUERCETIN 3,7-DIGLUCOSIDE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C27H30O17
Molecular Weight	626.5169
Optical Activity	UNSPECIFIED
Defined Stereocenters	10 / 10
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OC[C@H]1O[C@@H](OC2=CC(O)=C3C(=O)C(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)=C(OC3=C2)C5=CC=C(O)C(O)=C5)[C@H](O)[C@@H](O)[C@@H]1O

InChI

InChIKey=BNSCASRSSGJHQH-DEFKTLOSSA-N

InChI=1S/C27H30O17/c28-6-14-17(33)20(36)22(38)26(42-14)40-9-4-12(32)16-13(5-9)41-24(8-1-2-10(30)11(31)3-8)25(19(16)35)44-27-23(39)21(37)18(34)15(7-29)43-27/h1-5,14-15,17-18,20-23,26-34,36-39H,6-7H2/t14-,15-,17-,18-,20+,21+,22-,23-,26-,27+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C27H30O17
Molecular Weight	626.5169
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	10 / 10
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

PubMed

Title	Date	PubMed
[Isolation and structure identification of chemical constituents from the seeds of Descurainia sophia (L.) Webb ex Prantl].	2004 Jan	15127581

Substance Class	Chemical Created by `admin` on `Fri Dec 15 20:16:52 UTC 2023` Edited by `admin` on `Fri Dec 15 20:16:52 UTC 2023`
Record UNII	S2L05XBF3A
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

QUERCETIN 3,7-DIGLUCOSIDE

Common Name

English

4H-1-BENZOPYRAN-4-ONE, 2-(3,4-DIHYDROXYPHENYL)-3,7-BIS(.BETA.-D-GLUCOPYRANOSYLOXY)-5-HYDROXY-

Common Name

English

FLAVONE, 3,3',4',5,7-PENTAHYDROXY-, 3,7-DI-.BETA.-D-GLUCOPYRANOSIDE

Common Name

English

3,7-DIGLUCOSYLQUERCETIN

Common Name

English

QUERCETIN-3,7-O-.BETA.-DIGLUCOPYRANOSIDE

Common Name

English

Code System Code Type Description

CAS

6892-74-6