Rhamnetin-3-β-D-glucopyranoside

Rhamnetin-3-β-D-glucopyranoside
Compound Structure:
Synonyms: Rhamnetin 3-O-|A-D-glucopyranoside; rhamnetin 3-O-glucoside ;HY-N11770 ;CS-0834517
Compound ID: NMPC-1452
PubChem ID:

14704554
Molecular Formula: C22H22O12
Canonical SMILES: COC1=CC(=C2C(=C1)OC(=C(C2=O)OC3C(C(C(C(O3)CO)O)O)O)C4=CC(=C(C=C4)O)O)O
InChIKey: PHEWILLIAJUBQE-LFXZADKFSA-N
About the compound:
Properties:

Chemical and Physical Properties

Property Name

Property Value

Molecular Weight

478.4 g/mol

XLogP3-AA

0.7

Hydrogen Bond Donor Count

7

Hydrogen Bond Acceptor Count

12

Rotatable Bond Count

5

Exact Mass

478.11112613 g/mol

Monoisotopic Mass

478.11112613 g/mol

Topological Polar Surface Area

196Ų

Heavy Atom Count

34

Formal Charge

0

Complexity

773

Isotope Atom Count

0

Defined Atom Stereocenter Count

5

Undefined Atom Stereocenter Count

0

Defined Bond Stereocenter Count

0

Undefined Bond Stereocenter Count

0

Covalently-Bonded Unit Count

1

Compound Is Canonicalized

Yes

Source: PubChem                                                                                                                    
Source Species: Carissa edulis
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