PETUNIDIN CHLORIDE

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C16H13O7.Cl
Molecular Weight	352.723
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of PETUNIDIN CHLORIDE

Structure Search

SMILES

[Cl-].COC1=C(O)C(O)=CC(=C1)C2=C(O)C=C3C(O)=CC(O)=CC3=[O+]2

InChI

InChIKey=QULMBDNPZCFSPR-UHFFFAOYSA-N

InChI=1S/C16H12O7.ClH/c1-22-14-3-7(2-11(19)15(14)21)16-12(20)6-9-10(18)4-8(17)5-13(9)23-16;/h2-6H,1H3,(H4-,17,18,19,20,21);1H

HIDE SMILES / InChI

Molecular Formula	ClH
Molecular Weight	36.461
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	C16H12O7
Molecular Weight	316.2623
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Approval Year

PubMed

PubMed

Title	Date	PubMed
Electron spin resonance spectroscopy studies on the free radical scavenging activity of wine anthocyanins and pyranoanthocyanins.	2005 Dec	16254886

Substance Class	Chemical Created by `admin` on `Fri Dec 15 17:51:42 GMT 2023` Edited by `admin` on `Fri Dec 15 17:51:42 GMT 2023`
Record UNII	WRK4Q8K2D8
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

PETUNIDIN CHLORIDE

Common Name

English

PETUNIDIN

Common Name

English

PETUNIDOL

Common Name

English

PETUNIDIN [MI]

Common Name

English

2-(3,4-DIHYDROXY-5-METHOXYPHENYL)-3,5,7-TRIHYDROXY-1-BENZOPYRYLIUM CHLORIDE

Systematic Name

English

3,3',4',5,7-PENTAHYDROXY-5'-METHOXYFLAVYLIUM CHLORIDE

Systematic Name

English

NSC-11907

Code

English

Classification Tree Code System Code

NCI_THESAURUS

C68444

Created by admin on Fri Dec 15 17:51:42 GMT 2023 , Edited by admin on Fri Dec 15 17:51:42 GMT 2023

Code System Code Type Description

CHEBI

75318

Created by admin on Fri Dec 15 17:51:42 GMT 2023 , Edited by admin on Fri Dec 15 17:51:42 GMT 2023

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PUBCHEM

73386

Created by admin on Fri Dec 15 17:51:42 GMT 2023 , Edited by admin on Fri Dec 15 17:51:42 GMT 2023

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MERCK INDEX

m8575

Created by admin on Fri Dec 15 17:51:42 GMT 2023 , Edited by admin on Fri Dec 15 17:51:42 GMT 2023

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Merck Index

CAS

1429-30-7

Created by admin on Fri Dec 15 17:51:42 GMT 2023 , Edited by admin on Fri Dec 15 17:51:42 GMT 2023

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NSC

11907

Created by admin on Fri Dec 15 17:51:42 GMT 2023 , Edited by admin on Fri Dec 15 17:51:42 GMT 2023

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EPA CompTox

DTXSID90931677

Created by admin on Fri Dec 15 17:51:42 GMT 2023 , Edited by admin on Fri Dec 15 17:51:42 GMT 2023

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ECHA (EC/EINECS)

215-849-4

Created by admin on Fri Dec 15 17:51:42 GMT 2023 , Edited by admin on Fri Dec 15 17:51:42 GMT 2023

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NCI_THESAURUS

C68449

Created by admin on Fri Dec 15 17:51:42 GMT 2023 , Edited by admin on Fri Dec 15 17:51:42 GMT 2023

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WIKIPEDIA

PETUNIDIN

Created by admin on Fri Dec 15 17:51:42 GMT 2023 , Edited by admin on Fri Dec 15 17:51:42 GMT 2023

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MESH

C473206

Created by admin on Fri Dec 15 17:51:42 GMT 2023 , Edited by admin on Fri Dec 15 17:51:42 GMT 2023

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CHEBI

75035

Created by admin on Fri Dec 15 17:51:42 GMT 2023 , Edited by admin on Fri Dec 15 17:51:42 GMT 2023

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FDA UNII

WRK4Q8K2D8

Created by admin on Fri Dec 15 17:51:42 GMT 2023 , Edited by admin on Fri Dec 15 17:51:42 GMT 2023

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