Vinamidine
AlkaPlorer ID: AK225094
Synonym: Catharinine
IUPAC Name: methyl 11-acetyloxy-12-ethyl-4-[3-formyl-7-methoxycarbonyl-5-(2-oxobutyl)-1,2,4,5,6,8-hexahydroazonino[5,4-b]indol-7-yl]-10-hydroxy-5-methoxy-8-methyl-8,16-diazapentacyclo[10.6.1.01,9.02,7.016,19]nonadeca-2,4,6,13-tetraene-10-carboxylate
Structure
SMILES: CCC(=O)CC1CN(C=O)CCC2=C(NC3=CC=CC=C23)C(C(=O)OC)(C2=CC3=C(C=C2OC)N(C)C2C(O)(C(=O)OC)C(OC(C)=O)C4(CC)C=CCN5CCC32C54)C1
InChI: InChI=1S/C46H56N4O10/c1-8-29(53)21-28-24-45(41(54)58-6,37-31(15-19-49(25-28)26-51)30-13-10-11-14-34(30)47-37)33-22-32-35(23-36(33)57-5)48(4)39-44(32)17-20-50-18-12-16-43(9-2,38(44)50)40(60-27(3)52)46(39,56)42(55)59-7/h10-14,16,22-23,26,28,38-40,47,56H,8-9,15,17-21,24-25H2,1-7H3
InChIKey: AQXVANXWKSPKMX-UHFFFAOYSA-N
Source
Properties Information
Molecule Weight: 824.9719999999999
TPSA？: 168.01
MolLogP？: 3.971700000000003
Number of H-Donors: 2
Number of H-Acceptors: 12
RingCount: 8
Activities Information
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