Blumeatin

CAT: 1410-M23347-02Size: 5 mgDry Ice: NoHazardous: No

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CAT#:1410-M23347-02Size:5 mg

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Description

Blumeatin has antioxidant properties, free radical scavenging activity, and has xanthine oxidase (XO) inhibitory activity.

CAS Number

118024-26-3

Stability

≥ 2 years

Purity

>98% (HPLC)

Weight

302.29

Molecular Formula

C16H14O6

Notes

Research use only, not for human use.

Receptor

Chemical Information

Blumeatin

Blumeatin is an ether and a member of flavonoids.

CAS Number	118024-26-3
PubChem CID	70696494
IUPAC Name	(2S)-2-(3,5-dihydroxyphenyl)-5-hydroxy-7-methoxy-2,3-dihydrochromen-4-one
Molecular Formula	C16H14O6
Molecular Weight	302.28
XLogP	2.4
Topological Polar Surface Area	96.2
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	2
Heavy Atom Count	22
Formal Charge	0
Complexity	403

SMILES

COC1=CC(=C2C(=O)C[C@H](OC2=C1)C3=CC(=CC(=C3)O)O)O

InChI

InChI=1S/C16H14O6/c1-21-11-5-12(19)16-13(20)7-14(22-15(16)6-11)8-2-9(17)4-10(18)3-8/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1

InChIKey

YEYLMQKEGSQNGZ-AWEZNQCLSA-N

Chemical Structure

2D Structure

CAS: 118024-26-3

CID: 70696494

Formula: C16H14O6

MW: 302.28

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	302.28
XLogP3	2.4
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	2
Exact Mass	302.07903816
Monoisotopic Mass	302.07903816
Topological Polar Surface Area	96.2 Å²
Heavy Atom Count	22
Formal Charge	0
Complexity	403
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes