Record Information
Version1.0
StatusDetected and Quantified
Creation Date2021-11-19 04:58:26 UTC
Update Date2022-08-31 22:37:39 UTC
MiMeDB IDMMDBc0033674
Metabolite Identification
Common NameMalvidin glucoside-ethyl-catechin
DescriptionMalvidin glucoside-ethyl-catechin is a flavanol-anthocyanin adduct, a type of pyranoanthocyanin. Flavanol-anthocyanin adducts are formed during wine ageing through reactions between anthocyanins and tannins present in grape, with yeast metabolites such as acetaldehyde. Acetaldehyde-induced reactions yield ethyl-linked species such as malvidin glucoside-ethyl-catechin. [PMID: 17303275 ]
Structure
SynonymsNot Available
Chemical FormulaC41H43O17
Average Molecular Weight807.7699
Monoisotopic Molecular Weight807.25002495
IUPAC NameNot Available
Traditional NameNot Available
CAS Registry NumberNot Available
SMILESNot Available
InChI Identifier
InChI=1S/C41H42O17/c1-15(33-20-9-18(16-4-5-22(43)26(47)6-16)23(44)10-19(20)24(45)12-27(33)48)34-28(49)13-25(46)21-11-31(56-41-38(53)37(52)36(51)32(14-42)57-41)39(58-40(21)34)17-7-29(54-2)35(50)30(8-17)55-3/h4-8,11-13,15,18,23,32,36-38,41-42,44,51-53H,9-10,14H2,1-3H3,(H6-,43,45,46,47,48,49,50)/p+1/t15?,18?,23?,32-,36-,37+,38-,41-/m1/s1
InChI KeyPDKUNOMSMBMTCT-BDXLLLNFSA-O