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Mulberrin

CAT: 0013-GTR19155123-05Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19155123-05Size:10 mg
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Description
Mulberrin is an inhibitor of OATP2B1-mediated estrone-3-sulfate (E3S) uptake (IC50: 1.8 ±1.5 μM) .
CAS Number
62949-79-5
Product Name Alternative
Kuwanon C
Purity
>98% (HPLC)
Solubility
DMSO:Soluble
Smiles
C/C (C) =C\CC1=C2C (C (C (C/C=C (C) \C) =C (C3=C (C=C (O) C=C3) O) O2) =O) =C (O) C=C1O
Molecular Formula
C25H26O6
Molecular Weight
422.47
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.

Chemical Information

Kuwanon C

Mulberrin has been reported in Morus mongolica, Artocarpus gomezianus, and other organisms with data available.

CAS Number62949-79-5
PubChem CID5481958
IUPAC Name2-(2,4-dihydroxyphenyl)-5,7-dihydroxy-3,8-bis(3-methylbut-2-enyl)chromen-4-one
Molecular FormulaC25H26O6
Molecular Weight422.5
XLogP6.2
Topological Polar Surface Area107
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Heavy Atom Count31
Formal Charge0
Complexity758
SMILES
CC(=CCC1=C2C(=C(C=C1O)O)C(=O)C(=C(O2)C3=C(C=C(C=C3)O)O)CC=C(C)C)C
InChI
InChI=1S/C25H26O6/c1-13(2)5-8-17-20(28)12-21(29)22-23(30)18(9-6-14(3)4)24(31-25(17)22)16-10-7-15(26)11-19(16)27/h5-7,10-12,26-29H,8-9H2,1-4H3
InChIKey
UWQYBLOHTQWSQD-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Kuwanon C
CAS: 62949-79-5
CID: 5481958
Formula: C25H26O6
MW: 422.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight422.5
XLogP36.2
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Exact Mass422.17293854
Monoisotopic Mass422.17293854
Topological Polar Surface Area107 Ų
Heavy Atom Count31
Formal Charge0
Complexity758
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
TQ0161-01Mulberrin
HY-N3513RMulberrin (Standard)
371701Mulberrin discontinued

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