Persicogenin

CAT: 0926-DBA59040-02Size: 5 mgDry Ice: NoHazardous: No

1 / 1

CAT#:0926-DBA59040-02Size:5 mg

Selected

24/48H Stock Items & 2 to 6 Weeks non Stock Items.

Quick Request Actions

CAS Number

28590-40-1

Smiles

COC1=C (C=C (C=C1) C2CC (=O) C3=C (C=C (C=C3O2) OC) O) O

Molecular Formula

C17H16O6

Molecular Weight

316.3 g/mol

Controlled

Chemical Information

Persicogenin

3',5-Dihydroxy-4',7-dimethoxyflavanone is an ether and a member of flavonoids.

CAS Number	28590-40-1
PubChem CID	320054
IUPAC Name	5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-7-methoxy-2,3-dihydrochromen-4-one
Molecular Formula	C17H16O6
Molecular Weight	316.30
XLogP	2.7
Topological Polar Surface Area	85.2
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	3
Heavy Atom Count	23
Formal Charge	0
Complexity	427

SMILES

COC1=C(C=C(C=C1)C2CC(=O)C3=C(C=C(C=C3O2)OC)O)O

InChI

InChI=1S/C17H16O6/c1-21-10-6-12(19)17-13(20)8-15(23-16(17)7-10)9-3-4-14(22-2)11(18)5-9/h3-7,15,18-19H,8H2,1-2H3

InChIKey

LWBHKKLWSUFUNZ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 28590-40-1

CID: 320054

Formula: C17H16O6

MW: 316.30

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	316.30
XLogP3	2.7
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	3
Exact Mass	316.09468823
Monoisotopic Mass	316.09468823
Topological Polar Surface Area	85.2 Å²
Heavy Atom Count	23
Formal Charge	0
Complexity	427
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
HY-N7636-01	Persicogenin