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Details

Stereochemistry ABSOLUTE
Molecular Formula C20H19O11
Molecular Weight 435.3583
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 1

SHOW SMILES / InChI
Structure of DELPHINIDIN 3-ARABINOSIDE CATION

SMILES

O[C@H]1CO[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C4=CC(O)=C(O)C(O)=C4)[C@H](O)[C@H]1O

InChI

InChIKey=XZUBZVMZVWFBNE-NTCOEUGSSA-O
InChI=1S/C20H18O11/c21-8-3-10(22)9-5-15(31-20-18(28)17(27)13(25)6-29-20)19(30-14(9)4-8)7-1-11(23)16(26)12(24)2-7/h1-5,13,17-18,20,25,27-28H,6H2,(H4-,21,22,23,24,26)/p+1/t13-,17-,18+,20-/m0/s1

HIDE SMILES / InChI

Molecular Formula C20H18O11
Molecular Weight 434.3503
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 11:19:16 GMT 2023
Edited
by admin
on Sat Dec 16 11:19:16 GMT 2023
Record UNII
IQB8DCB8KJ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DELPHINIDIN 3-ARABINOSIDE CATION
Common Name English
DELPHINIDIN-3-O-ARABINOSIDE CATION
Common Name English
1-BENZOPYRYLIUM, 3-(ARABINOSYLOXY)-5,7-DIHYDROXY-2-(3,4,5-TRIHYDROXYPHENYL)-
Systematic Name English
1-BENZOPYRYLIUM, 3-(.ALPHA.-L-ARABINOPYRANOSYLOXY)-5,7-DIHYDROXY-2-(3,4,5-TRIHYDROXYPHENYL)-
Systematic Name English
Code System Code Type Description
CAS
771412-91-0
Created by admin on Sat Dec 16 11:19:16 GMT 2023 , Edited by admin on Sat Dec 16 11:19:16 GMT 2023
NON-SPECIFIC SUBSTITUTION
PUBCHEM
12137508
Created by admin on Sat Dec 16 11:19:16 GMT 2023 , Edited by admin on Sat Dec 16 11:19:16 GMT 2023
PRIMARY
CAS
324533-67-7
Created by admin on Sat Dec 16 11:19:16 GMT 2023 , Edited by admin on Sat Dec 16 11:19:16 GMT 2023
PRIMARY
FDA UNII
IQB8DCB8KJ
Created by admin on Sat Dec 16 11:19:16 GMT 2023 , Edited by admin on Sat Dec 16 11:19:16 GMT 2023
PRIMARY