Products for Research Use Only

4-Hydroxylonchocarpin

CAT: 0931-T2S0142-02Size: 1 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0931-T2S0142-02Size:1 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
56083-03-5
Target
P38 MAPK, Others
Related Pathways
Others, MAPK
Purity
0.9996
Bioactivity
4-Hydroxylonchocarpin is a natural product from Psoralea corylifolia
Smiles
OC1=C2C(=CC=C1C(/C=C/C3=CC=C(O)C=C3)=O)OC(C)(C)C=C2
Molecular Formula
C20H18O4
Molecular Weight
322.35
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

4-Hydroxylonchocarpin

Isobavachromene has been reported in Mundulea sericea, Dorstenia dinklagei, and other organisms with data available.

CAS Number56083-03-5
PubChem CID5889042
IUPAC Name(E)-1-(5-hydroxy-2,2-dimethylchromen-6-yl)-3-(4-hydroxyphenyl)prop-2-en-1-one
Molecular FormulaC20H18O4
Molecular Weight322.4
XLogP4.5
Topological Polar Surface Area66.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Heavy Atom Count24
Formal Charge0
Complexity514
SMILES
CC1(C=CC2=C(O1)C=CC(=C2O)C(=O)/C=C/C3=CC=C(C=C3)O)C
InChI
InChI=1S/C20H18O4/c1-20(2)12-11-16-18(24-20)10-8-15(19(16)23)17(22)9-5-13-3-6-14(21)7-4-13/h3-12,21,23H,1-2H3/b9-5+
InChIKey
IQHPDUUSMBMDGN-WEVVVXLNSA-N
Chemical Structure
2D Structure
2D structure of 4-Hydroxylonchocarpin
CAS: 56083-03-5
CID: 5889042
Formula: C20H18O4
MW: 322.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight322.4
XLogP34.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass322.12050905
Monoisotopic Mass322.12050905
Topological Polar Surface Area66.8 Ų
Heavy Atom Count24
Formal Charge0
Complexity514
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes