PETUNIDIN 3-ARABINOSIDE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C21H21O11.Cl
Molecular Weight	484.838
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[Cl-].COC1=C(O)C(O)=CC(=C1)C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]4OC[C@H](O)[C@H](O)[C@H]4O

InChI

InChIKey=DGLWRNZJQCODBU-IMBWBGPSSA-N

InChI=1S/C21H20O11.ClH/c1-29-15-3-8(2-12(24)17(15)26)20-16(32-21-19(28)18(27)13(25)7-30-21)6-10-11(23)4-9(22)5-14(10)31-20;/h2-6,13,18-19,21,25,27-28H,7H2,1H3,(H3-,22,23,24,26);1H/t13-,18-,19+,21-;/m0./s1

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	C21H20O11
Molecular Weight	448.3769
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	4 / 4
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 07:57:41 GMT 2023` Edited by `admin` on `Sat Dec 16 07:57:41 GMT 2023`
Record UNII	BZ15OON7AW
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

PETUNIDIN 3-ARABINOSIDE

Common Name

English

PETUNIDIN-3-O-ARABINOSIDE

Common Name

English

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

Systematic Name

English

1-BENZOPYRYLIUM, 3-(.ALPHA.-L-ARABINOPYRANOSYLOXY)-2-(3,4-DIHYDROXY-5-METHOXYPHENYL)-5,7-DIHYDROXY-, CHLORIDE (1:1)

Systematic Name

English

PETUNIDIN 3-O-.ALPHA.-L-ARABINOPYRANOSIDE

Common Name

English

Code System Code Type Description

CAS

28500-03-0

Created by admin on Sat Dec 16 07:57:42 GMT 2023 , Edited by admin on Sat Dec 16 07:57:42 GMT 2023

NON-SPECIFIC SUBSTITUTION

PUBCHEM

91810653

Created by admin on Sat Dec 16 07:57:42 GMT 2023 , Edited by admin on Sat Dec 16 07:57:42 GMT 2023

PRIMARY

FDA UNII

BZ15OON7AW

Created by admin on Sat Dec 16 07:57:42 GMT 2023 , Edited by admin on Sat Dec 16 07:57:42 GMT 2023

PRIMARY

CAS

679429-94-8

Created by admin on Sat Dec 16 07:57:42 GMT 2023 , Edited by admin on Sat Dec 16 07:57:42 GMT 2023

PRIMARY