Homoeriodictyol chalcone

CAT: 1407-AB0925Size: 20 mgDry Ice: NoHazardous: No

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CAT#:1407-AB0925Size:20 mg

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CAS Number

52218-19-6

Purity

98% (HPLC)

Molecular Formula

C16H14O6

Molecular Weight

302.28

Chemical Information

2',4,4',6'-Tetrahydroxy-3-methoxychalcone

2',4,4',6'-Tetrahydroxy-3-methoxychalcone has been reported in Tulipa with data available.

CAS Number	52218-19-6
PubChem CID	103608
IUPAC Name	3-(4-hydroxy-3-methoxyphenyl)-1-(2,4,6-trihydroxyphenyl)prop-2-en-1-one
Molecular Formula	C16H14O6
Molecular Weight	302.28
XLogP	2.9
Topological Polar Surface Area	107
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	4
Heavy Atom Count	22
Formal Charge	0
Complexity	397

SMILES

COC1=C(C=CC(=C1)C=CC(=O)C2=C(C=C(C=C2O)O)O)O

InChI

InChI=1S/C16H14O6/c1-22-15-6-9(2-4-11(15)18)3-5-12(19)16-13(20)7-10(17)8-14(16)21/h2-8,17-18,20-21H,1H3

InChIKey

WQWVIIRCVOZVPN-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 52218-19-6

CID: 103608

Formula: C16H14O6

MW: 302.28

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	302.28
XLogP3	2.9
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	4
Exact Mass	302.07903816
Monoisotopic Mass	302.07903816
Topological Polar Surface Area	107 Å²
Heavy Atom Count	22
Formal Charge	0
Complexity	397
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	1
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
AB2648	Homoeriodictyol
AB0305	Naringenin chalcone
AB1934	Pinocembrin chalcone
AB2835	Homoeriodictyol 7-O-β-D-glucoside
AB1941	Hesperidine Methyl Chalcone