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Details

Stereochemistry ACHIRAL
Molecular Formula C23H25O12.Cl
Molecular Weight 528.89
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MALVIDIN 3-GALACTOSIDE

SMILES

[Cl-].COC1=CC(=CC(OC)=C1O)C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O

InChI

InChIKey=YDIKCZBMBPOGFT-PWUSVEHZSA-N
InChI=1S/C23H24O12.ClH/c1-31-14-3-9(4-15(32-2)18(14)27)22-16(7-11-12(26)5-10(25)6-13(11)33-22)34-23-21(30)20(29)19(28)17(8-24)35-23;/h3-7,17,19-21,23-24,28-30H,8H2,1-2H3,(H2-,25,26,27);1H/t17-,19+,20+,21-,23-;/m1./s1

HIDE SMILES / InChI

Molecular Formula C23H24O12
Molecular Weight 492.4295
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 5 / 5
E/Z Centers 0
Optical Activity UNSPECIFIED

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

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 19:10:43 GMT 2023
Edited
by admin
on Sat Dec 16 19:10:43 GMT 2023
Record UNII
MB4022065G
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
MALVIDIN 3-GALACTOSIDE
Common Name English
NSC-270760
Code English
MALVIDIN GALACTOSIDE
Common Name English
MALVIDIN 3-O-.BETA.-D-GALACTOPYRANOSIDE
Common Name English
1-BENZOPYRYLIUM, 3-(.BETA.-D-GALACTOPYRANOSYLOXY)-5,7-DIHYDROXY-2-(4-HYDROXY-3,5-DIMETHOXYPHENYL)-, CHLORIDE (1:1)
Systematic Name English
ARTHANITIN
Common Name English
MALVIDIN-3-O-GALACTOSIDE
Common Name English
PRIMULIN
Common Name English
Code System Code Type Description
PUBCHEM
94409
Created by admin on Sat Dec 16 19:10:43 GMT 2023 , Edited by admin on Sat Dec 16 19:10:43 GMT 2023
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CAS
30113-37-2
Created by admin on Sat Dec 16 19:10:43 GMT 2023 , Edited by admin on Sat Dec 16 19:10:43 GMT 2023
PRIMARY
EPA CompTox
DTXSID90952524
Created by admin on Sat Dec 16 19:10:43 GMT 2023 , Edited by admin on Sat Dec 16 19:10:43 GMT 2023
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ECHA (EC/EINECS)
250-055-1
Created by admin on Sat Dec 16 19:10:43 GMT 2023 , Edited by admin on Sat Dec 16 19:10:43 GMT 2023
PRIMARY
NSC
270760
Created by admin on Sat Dec 16 19:10:43 GMT 2023 , Edited by admin on Sat Dec 16 19:10:43 GMT 2023
PRIMARY
FDA UNII
MB4022065G
Created by admin on Sat Dec 16 19:10:43 GMT 2023 , Edited by admin on Sat Dec 16 19:10:43 GMT 2023
PRIMARY
WIKIPEDIA
Malvidin 3-galactoside
Created by admin on Sat Dec 16 19:10:43 GMT 2023 , Edited by admin on Sat Dec 16 19:10:43 GMT 2023
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