5,7-Dihydroxy-3-(3,4,5-Trihydroxy-6-Methyloxan-2-Yl)Oxy-2-(3,4,5-Trihydroxyphenyl)Chromen-4-One

HCID 5352000CAS 17912-87-7
Substructure searchFind similar structures

Basic information

Standard SMILES
CC1OC(Oc2c(-c3cc(O)c(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)C(O)C(O)C1O
InChIKey
DCYOADKBABEMIQ-UHFFFAOYSA-N
Molecular formula
C21H20O12
Average molar mass
464.4 g/mol
Monoisotopic mass
464.09547608

Overview

myricitrin has been reported in Mycoacia fuscoatra, Glochidion sphaerogynum, and other organisms with data available.

Names & identifiers

Preferred name
5,7-Dihydroxy-3-(3,4,5-Trihydroxy-6-Methyloxan-2-Yl)Oxy-2-(3,4,5-Trihydroxyphenyl)Chromen-4-One
IUPAC
5,7-dihydroxy-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy-2-(3,4,5-trihydroxyphenyl)chromen-4-one

Names & synonyms

5,7-dihydroxy-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy-2-(3,4,5-trihydroxyphenyl)chromen-4-oneRefChem:1072260Myricetin 3-rhamnosideMLS000737865Rhamnoside,myricetin-3Myricetin 3-O-L-rhamnosideMyricetol 3-rhamnosideSMR0005281965,7-dihydroxy-3-(3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl)oxy-2-(3,4,5-trihydroxyphenyl)chromen-4-oneMyricetin-3-O-alpha-L-rhamnosideMyricetin 3-O-.alpha.-L-rhamnopyranosideMyricitrin (8CI)
Show more names
Myricitrin [M+H]+Flavone,3,3',4',5,5',7-hexahydroxy-,3-rhamnosideCHEMBL1599224SCHEMBL13240936cid_5352000DTXSID60864807DCYOADKBABEMIQ-UHFFFAOYSA-NBDBM115130

Database identifiers

CAS
17912-87-7
PubChem CID
5352000
DTXSID
DTXSID60864807
ChEMBL
CHEMBL1599224

Properties

Computed structural properties

XLogP
0.5
Topological polar surface area
207 Ų
Hydrogen bond donors
8
Hydrogen bond acceptors
12
Rotatable bonds
3
Heavy atoms
33

Experimental & physicochemical properties

Melting Point194 - 197 °C
Physical DescriptionSolid

Chemistry & industry

Pharmacology

Cellular LocationsCytoplasm

Related reactions

1 records
New reaction record

Linked notes

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