Cas no 143885-79-4 (O-Demethylcitrunobin; 3-Methoxy, 4,4'-di-Me ether)

O-Demethylcitrunobin; 3-Methoxy, 4,4'-di-Me ether structure
143885-79-4 structure
Product Name:O-Demethylcitrunobin; 3-Methoxy, 4,4'-di-Me ether
CAS No:143885-79-4
MF:C23H24O6
MW:396.433067321777
CID:6673453
Update Time:2024-03-02

O-Demethylcitrunobin; 3-Methoxy, 4,4'-di-Me ether Chemical and Physical Properties

Names and Identifiers

    • 6'',6''-Dimethylpyrano[2'',3'':6',5']-2'-hydroxy-3,4,4'-trimethoxychalcone
    • O-Demethylcitrunobin; 3-Methoxy, 4,4'-di-Me ether
    • Inchi: 1S/C23H24O6/c1-23(2)11-10-15-19(27-4)13-17(25)21(22(15)29-23)16(24)8-6-14-7-9-18(26-3)20(12-14)28-5/h6-13,25H,1-5H3
    • InChI Key: MYVVQLOQHTYUSA-UHFFFAOYSA-N
    • SMILES: COC1C(OC)=CC(C=CC(C2C3=C(C=CC(O3)(C)C)C(OC)=CC=2O)=O)=CC=1

Computed Properties

  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 29
  • XLogP3: 3.156
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