QUERCETIN 3,7-DIGLUCOSIDE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C27H30O17
Molecular Weight	626.518
Optical Activity	UNSPECIFIED
Defined Stereocenters	10 / 10
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

c1cc(c(cc1-c2c(c(=O)c3c(cc(cc3o2)O[C@@]4([H])[C@@]([H])([C@]([H])([C@@]([H])([C@@]([H])(CO)O4)O)O)O)O)O[C@@]5([H])[C@@]([H])([C@]([H])([C@@]([H])([C@@]([H])(CO)O5)O)O)O)O)O

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	626.518
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 `Sat Jun 26 15:33:30 UTC 2021` Edited by `admin` on `Sat Jun 26 15:33:30 UTC 2021`
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

Created by admin on Sat Jun 26 15:33:30 UTC 2021 , Edited by admin on Sat Jun 26 15:33:30 UTC 2021

PRIMARY

PUBCHEM

10121947

Created by admin on Sat Jun 26 15:33:30 UTC 2021 , Edited by admin on Sat Jun 26 15:33:30 UTC 2021

PRIMARY

EPA CompTox

6892-74-6

Created by admin on Sat Jun 26 15:33:30 UTC 2021 , Edited by admin on Sat Jun 26 15:33:30 UTC 2021

PRIMARY

FDA UNII

S2L05XBF3A

Created by admin on Sat Jun 26 15:33:30 UTC 2021 , Edited by admin on Sat Jun 26 15:33:30 UTC 2021

PRIMARY

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