(Q3137150)

Petunidin chloride (English)

5 October 2016

0 references

C₁₆H₁₃ClO₇

1 reference

Petunidin chloride (English)

5 October 2016

canonical SMILES

COC1=CC(=CC(=C1O)O)C2=C(C=C3C(=CC(=CC3=[O+]2)O)O)O.[Cl-]

1 reference

Petunidin chloride (English)

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

5 October 2016

subject has role

biological pigment

0 references

Identifiers

InChI

1 reference

Petunidin chloride (English)

QULMBDNPZCFSPR-UHFFFAOYSA-N

5 October 2016

InChIKey

2 references

Petunidin chloride (English)

5 October 2016

ChEBI release 2020-09-01

2 references

petunidin chloride (English)

QULMBDNPZCFSPR-UHFFFAOYSA-N

5 October 2016

InChIKey

8 April 2021

https://commonchemistry.cas.org/detail?cas_rn=1429-30-7

1 reference

3,3',4',5,7-Pentahydroxy-5'-methoxyflavylium chloride (7CI) (English)

5 October 2016

1 reference

Petunidin chloride (English)

5 October 2016

Reaxys registry number

3897980

1 reference

petunidin chloride (English)

5 October 2016

ChEBI ID

75035

mapping relation type

1 reference

DSSTOX compound identifier

petunidin chloride (English)

5 October 2016

1 reference

0 references

0 references

0 references

215-849-4

1 reference

Global Substance Registration System

UNII

WRK4Q8K2D8

PETUNIDIN CHLORIDE (English)

ECHA Substance Infocard ID

5 October 2016

100.014.409

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.014.409

27 December 2018

Human Metabolome Database ID

2-(3,4-dihydroxy-5-methoxyphenyl)-3,5,7-trihydroxy-1-benzopyrylium chloride (English)

quotation

CAS no.: 1429-30-7 (English)

0 references

1 reference

inferred from InChIKey

UNII

WRK4Q8K2D8

1 reference

Global Substance Registration System

UNII

WRK4Q8K2D8