9-Hydroxyisoascididemin; 9-Deoxy, 9-amino
AlkaPlorer ID: AK254973
Synonym: 9-Amino-8H-benzo[b]pyrido[4,3,2-de][1,10]phenanthrolin-8-one, 9-Aminoisoascididemin, Isocystodamine
IUPAC Name: 6-amino-3,10,20-triazapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-1(20),2,4,6,9,11,13(21),14,16,18-decaen-8-one
Structure
SMILES: NC1=CC=NC2=C1C(=O)C1=NC=CC3=C4C=CC=CC4=NC2=C13
InChI: InChI=1S/C18H10N4O/c19-11-6-8-20-15-14(11)18(23)17-13-10(5-7-21-17)9-3-1-2-4-12(9)22-16(13)15/h1-8H,(H2,19,20)
InChIKey: ZMXZTOOGVJKBAK-UHFFFAOYSA-N
Source
Properties Information
Molecule Weight: 298.30500000000006
TPSA？: 81.76
MolLogP？: 2.9716000000000014
Number of H-Donors: 1
Number of H-Acceptors: 5
RingCount: 5
Activities Information
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