Cy3(caf)diG5G

General

Type : Anthocyanin, Flavonoid, Glycoside, Natural, Hydroxycinnamic-ester

Chemical_Nomenclature : [(2R,3S,4S,5R,6S)-6-[2-(3,4-dihydroxyphenyl)-7-hydroxy-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromenylium-3-yl]oxy-3,4-dihydroxy-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]methyl 3-(3,4-dihydroxyphenyl)prop-2-enoate

Canonical SMILES : C1=CC(=C(C=C1C=CC(=O)OC[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)OC3=C([O+]=C4C=C(C=C(C4=C3)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)O)C6=CC(=C(C=C6)O)O)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O)O)O)O)O)O)O

InChI : InChI=1S\/C42H46O24\/c43-12-26-30(51)33(54)36(57)40(63-26)61-24-10-17(45)9-23-18(24)11-25(38(60-23)16-3-5-20(47)22(49)8-16)62-42-39(66-41-37(58)34(55)31(52)27(13-44)64-41)35(56)32(53)28(65-42)14-59-29(50)6-2-15-1-4-19(46)21(48)7-15\/h1-11,26-28,30-37,39-44,51-58H,12-14H2,(H4-,45,46,47,48,49,50)\/p+1\/t26-,27-,28-,30-,31-,32-,33+,34+,35+,36-,37-,39-,40-,41+,42-\/m1\/s1

InChIKey : OUIUOTNTXCBQGM-GXKMNUNHSA-O

Other name(s) :


MW : 935.8

Formula : C42H47O24+

CAS_number :

PubChem : 100930187

UniChem : OUIUOTNTXCBQGM-GXKMNUNHSA-O

Target

Structures : No structure

Families : LYsophospholipase_carboxylesterase

References (2)

Title : Metabolomics-based mechanistic insight into the targeted non-acylated anthocyanin enrichment in the water extract of red cabbage catalyzed by carboxylesterase - Yang_2025_Food.Chem_484_144428
Author(s) : Yang S , Li G , Xu L , Wang X , Wu J , Liao X , Xu Z
Ref : Food Chem , 484 :144428 , 2025
Abstract :
PubMedSearch : Yang_2025_Food.Chem_484_144428
PubMedID: 40286714
Gene_locus related to this paper: psefl-cxest

Title : A normalization strategy for cyanidin-3-diglucoside-5-glucoside recovery from red cabbage byproducts - Yang_2025_J.Clean.Prod_494_144965
Author(s) : Yang S , Yang P , Wang W , Wu J , Liao X , Xu Z
Ref : Journal of Cleaner Production , 494 :144965 , 2025
Abstract :
PubMedSearch : Yang_2025_J.Clean.Prod_494_144965
PubMedID:
Gene_locus related to this paper: psefl-cxest