MappiodineB
AlkaPlorer ID: AK008425
Synonym: None
IUPAC Name: (15S,16S,20S)-7-hydroxy-16-methyl-17-oxa-3,13-diazapentacyclo[11.8.0.02,10.04,9.015,20]henicosa-1,3,5,7,9,11,18-heptaene-19-carboxylic acid
Structure
SMILES: C[C@H]1[C@@H]2CN3C=CC4=C5C=C(C=CC5=NC4=C3C[C@@H]2C(=CO1)C(=O)O)O
InChI: InChI=1S/C20H18N2O4/c1-10-15-8-22-5-4-12-14-6-11(23)2-3-17(14)21-19(12)18(22)7-13(15)16(9-26-10)20(24)25/h2-6,9-10,13,15,23H,7-8H2,1H3,(H,24,25)/t10-,13-,15-/m0/s1
InChIKey: GGYLWSFJKQYBSV-XEGUGMAKSA-N
Source
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Properties Information
Molecule Weight: 350.3740000000001
TPSA？: 84.58000000000001
MolLogP？: 3.0224000000000015
Number of H-Donors: 2
Number of H-Acceptors: 5
RingCount: 5
Activities Information
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