Cas no 86527-32-4 (Cimilophytine)

Cimilophytine structure
Cimilophytine structure
Product Name:Cimilophytine
CAS No:86527-32-4
MF:C38H42N4O8
MW:682.762090206146
CID:2040132
Update Time:2025-03-10

Cimilophytine Chemical and Physical Properties

Names and Identifiers

    • Cimilophytine
    • Aspidospermidin-21-oic acid, 6,7-didehydro-15-[(11bR,11cR)-2,3,3a,5,6,11c-hexahydro-8,11c-dihydroxy-3-methyl-6-oxo-1H-indolo[3,2,1-de][1,5]naphthyridin-11b(4H)-yl]-17,19-dihydroxy-16-methoxy-1-(1-oxopropyl)-, γ-lactone (9CI)
    • Aspidospermidin-21-oic acid, 6,7-didehydro-15-[(11bR,11cR)-2,3,3a,5,6,11c-hexahydro-8,11c-dihydroxy-3-methyl-6-oxo-1H-indolo[3,2,1-de][1,5]naphthyridin-11b(4H)-yl]-17,19-dihydroxy-16-methoxy-1-(1-oxopropyl)-, γ-lactone
    • Inchi: 1S/C38H42N4O8/c1-4-27(44)41-25-11-13-34-12-6-16-40-18-15-36(25,38(34,40)50-29(46)20-34)22-19-23(33(49-3)32(47)31(22)41)35-14-17-39(2)26-9-10-28(45)42(37(26,35)48)30-21(35)7-5-8-24(30)43/h5-8,12,19,25-26,43,47-48H,4,9-11,13-18,20H2,1-3H3
    • InChI Key: SLZIAOCXRLDVLI-UHFFFAOYSA-N
    • SMILES: CCC(N1C2C(=CC(C34C5(C(CCC(N5C5C(O)=CC=CC=53)=O)N(C)CC4)O)=C(C=2O)OC)C23C45C(C=CCN4CC2)(CC(O5)=O)CCC13)=O

Experimental Properties

  • Density: 1.57±0.1 g/cm3(Predicted)
  • pka: 9.25±0.60(Predicted)
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