Kuwanon O

CAT: 0013-GTR19218378-01Size: 5 mgDry Ice: NoHazardous: No

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CAT#:0013-GTR19218378-01Size:5 mg

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Description

Kuwanon O is a flavonoid derivative characterized by a fused dihydrochalcone moiety, isolated from the root bark of Morus lhou. Research indicates it exhibits inhibitory activity against enzymes like α-glucosidase in vitro, suggesting potential for metabolic disorder studies.

CAS Number

89200-01-1

Smiles

C (=O) ([C@@H]1[C@H] (C=C (C) C[C@H]1C2=C (O) C=C (O) C=C2) C3=C (O) C (=CC=C3O) [C@H]4OC=5C (C (=O) C4) =C (O) C=C (O) C5) C6=C (O) C (CC=C (C) C) =C (O) C=C6

Molecular Formula

C40H38O11

Molecular Weight

694.72

Storage Conditions

-20°C

Notes

For research use only.

Chemical Information

Kuwanon O

Kuwanon O has been reported in Morus alba with data available.

CAS Number	89200-01-1
PubChem CID	102075992
IUPAC Name	(2S)-2-[3-[(1S,5R,6S)-6-[2,4-dihydroxy-3-(3-methylbut-2-enyl)benzoyl]-5-(2,4-dihydroxyphenyl)-3-methylcyclohex-2-en-1-yl]-2,4-dihydroxyphenyl]-5,7-dihydroxy-2,3-dihydrochromen-4-one
Molecular Formula	C40H38O11
Molecular Weight	694.7
XLogP	7
Topological Polar Surface Area	205
Hydrogen Bond Donor Count	8
Hydrogen Bond Acceptor Count	11
Rotatable Bond Count	7
Heavy Atom Count	51
Formal Charge	0
Complexity	1310

SMILES

CC1=C[C@@H]([C@H]([C@@H](C1)C2=C(C=C(C=C2)O)O)C(=O)C3=C(C(=C(C=C3)O)CC=C(C)C)O)C4=C(C=CC(=C4O)[C@@H]5CC(=O)C6=C(C=C(C=C6O5)O)O)O

InChI

InChI=1S/C40H38O11/c1-18(2)4-6-23-28(43)10-9-25(38(23)48)40(50)35-26(22-7-5-20(41)14-30(22)45)12-19(3)13-27(35)36-29(44)11-8-24(39(36)49)33-17-32(47)37-31(46)15-21(42)16-34(37)51-33/h4-5,7-11,13-16,26-27,33,35,41-46,48-49H,6,12,17H2,1-3H3/t26-,27-,33-,35-/m0/s1

InChIKey

YIHMXHFAOIEYBW-BHNQILPDSA-N

Chemical Structure

2D Structure

CAS: 89200-01-1

CID: 102075992

Formula: C40H38O11

MW: 694.7

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	694.7
XLogP3	7
Hydrogen Bond Donor Count	8
Hydrogen Bond Acceptor Count	11
Rotatable Bond Count	7
Exact Mass	694.24141202
Monoisotopic Mass	694.24141202
Topological Polar Surface Area	205 Å²
Heavy Atom Count	51
Formal Charge	0
Complexity	1310
Isotope Atom Count	0
Defined Atom Stereocenter Count	4
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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E7856-1mg	Kuwanon A
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AB0267	Kuwanon H
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Kuwanon O

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