Cyanidin 3-(caffeoylglucoside)

[3-(3,4-dihydroxyphenyl)-1-hydroxyprop-2-en-1-ylidene]({[(3S,6S)-6-{[2-(3,4-dihydroxyphenyl)-7-hydroxy-5-oxo-5H-chromen-3-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methyl})oxidanium

Formula: C30H27O14+ (611.1401)
Chinese Name: 矢车菊素3-(咖啡酰葡萄糖苷)
BioDeep ID: BioDeep_00000231975 ( View LC/MS Profile)
SMILES: [H]C1(C[O+]=C(O)C=CC2=CC(O)=C(O)C=C2)O[C@@]([H])(OC2=C(OC3=CC(O)=CC(=O)C3=C2)C2=CC(O)=C(O)C=C2)C([H])(O)C([H])(O)[C@]1([H])O



Found 8 Sample Hits

m/z Adducts Species Organ Scanning Sample
594.1263 [M+H-H2O]+
PPM:17.6		 Homo sapiens Liver MALDI (DHB)
20171107_FIT4_DHBpos_p70_s50 - Rappez et al (2021) SpaceM reveals metabolic states of single cells
Resolution: 50μm, 70x70

Description

611.1727 [M-H2O+NH4]+
PPM:15.3		 Homo sapiens Liver MALDI (DHB)
20171107_FIT4_DHBpos_p70_s50 - Rappez et al (2021) SpaceM reveals metabolic states of single cells
Resolution: 50μm, 70x70

Description

594.137 [M+H-H2O]+
PPM:0.4		 Mus musculus Left upper arm MALDI (CHCA)
357_l_total ion count - Limb defect imaging - Monash University
Resolution: 50μm, 97x131

Description

Diseased
594.1409 [M+H-H2O]+
PPM:6.9		 Mytilus edulis mantle MALDI (DHB)
20190201_MS38_Crassostrea_Mantle_350-1500_DHB_pos_A28_10um_270x210 - MTBLS2960
Resolution: 10μm, 270x210

Description

594.1403 [M+H-H2O]+
PPM:5.9		 Mytilus edulis mantle MALDI (DHB)
20190216_MS38_Mytilus_mantle_350-1500_DHB_pos_A26_10um_275x210 - MTBLS2960
Resolution: 10μm, 275x210

Description

629.1693 [M+NH4]+
PPM:7.3		 Mytilus edulis mantle MALDI (DHB)
20190216_MS38_Mytilus_mantle_350-1500_DHB_pos_A26_10um_275x210 - MTBLS2960
Resolution: 10μm, 275x210

Description

611.1448 [M]+
PPM:8.6		 Homo sapiens colorectal adenocarcinoma DESI ()
120TopL, 90TopR, 110BottomL, 100BottomR-centroid - MTBLS176
Resolution: 50μm, 132x136

Description

612.1485 [M+H]+
PPM:1.9		 Homo sapiens colorectal adenocarcinoma DESI ()
120TopL, 90TopR, 110BottomL, 100BottomR-centroid - MTBLS176
Resolution: 50μm, 132x136

Description


Isolated from grapes and other plant subspecies Cyanidin 3-(caffeoylglucoside) is found in many foods, some of which are gooseberry, black chokeberry, blackcurrant, and black elderberry.