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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 of PETUNIDIN 3-ARABINOSIDE

SMILES

[Cl-].COC1=CC(=CC(O)=C1O)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

Approval Year

Name Type Language
PETUNIDIN 3-ARABINOSIDE
Common Name English
PETUNIDIN 3-O-.ALPHA.-L-ARABINOPYRANOSIDE
Preferred 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
Code System Code Type Description
CAS
28500-03-0
Created by admin on Mon Mar 31 21:47:26 GMT 2025 , Edited by admin on Mon Mar 31 21:47:26 GMT 2025
NON-SPECIFIC SUBSTITUTION
PUBCHEM
91810653
Created by admin on Mon Mar 31 21:47:26 GMT 2025 , Edited by admin on Mon Mar 31 21:47:26 GMT 2025
PRIMARY
FDA UNII
BZ15OON7AW
Created by admin on Mon Mar 31 21:47:26 GMT 2025 , Edited by admin on Mon Mar 31 21:47:26 GMT 2025
PRIMARY
CAS
679429-94-8
Created by admin on Mon Mar 31 21:47:26 GMT 2025 , Edited by admin on Mon Mar 31 21:47:26 GMT 2025
PRIMARY