7-O-Methyl-cyanidin-3-O-galactoside

ScientificNameLabel

7-O-Methyl-cyanidin-3-O-galactoside
PHCD compound ID :	3208
Chemical Names :	7-O-Methyl-cyanidin-3-O-galactoside
Molecular Formula :	C22H23O11
Molecular Weight :	463.124037

More Details :

Names & Synonyms:
Smiles:	OC[C@H]1O[C@@H](Oc2cc3c(O)cc(cc3[o+]c2c2ccc(c(c2)O)O)OC)[C@@H]([C@H]([C@@H]1O)O)O
InChi :	InChI=1S/C22H22O11/c1-30-10-5-13(25)11-7-16(32-22-20(29)19(28)18(27)17(8-23)33-22)21(31-15(11)6-10)9-2-3-12(24)14(26)4-9/h2-7,17-20,22-23,27-29H,8H2,1H3,(H2-,24,25,26)/p+1/t17-,18-,19+,20-,22-/m1/s1
InChi Key :	InChIKey=KCDJRKUVAZMGGT-OUUKCGNVSA-O
PubChem ID :

Rotatable bond count :	5	Rule of five :	2
Hydrogen bond acceptor count :	11	Ionization potential :	12.128999
Hydrogen bond donor count :	7	Electric dipole moment :	10.169
XLogP :	0	VDW volume :	0
Molecular weight :	463.124037	HOMO-LUMO gap :	6.538000

Herb list :

Sumac - Rhus coriaria - سماق

Refrences & Litretures:


443. Journal:'Food Chemistry' Year:'2015' Volume:'166' Page:'179' DOI:'10.1016/j.foodchem.2014.06.011' Title:'HPLC–DAD–ESI-MS/MS screening of bioactive components from Rhus coriaria L. (Sumac) fruits'

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