Voacandimine C
AlkaPlorer ID: AK317798
Synonym: None
IUPAC Name: methyl 17-[[12-(2-hydroxyethyl)-10-methoxycarbonyl-8,16-diazapentacyclo[10.6.1.01,9.02,7.016,19]nonadeca-2,4,6,9,13-pentaen-14-yl]methyl]-15-oxa-8,19-diazahexacyclo[10.9.1.01,9.02,7.012,16.019,22]docosa-2,4,6,9-tetraene-10-carboxylate
Structure
SMILES: COC(=O)C1=C2NC3=CC=CC=C3C23CCN2CC(CC4CN5CCC67C(=C(C(=O)OC)CC8(CCOC48)C56)NC4=CC=CC=C47)=CC(CCO)(C1)C23
InChI: InChI=1S/C43H48N4O6/c1-51-36(49)27-21-40(13-17-48)20-25(23-46-15-11-42(38(40)46)29-7-3-5-9-31(29)44-33(27)42)19-26-24-47-16-12-43-30-8-4-6-10-32(30)45-34(43)28(37(50)52-2)22-41(39(43)47)14-18-53-35(26)41/h3-10,20,26,35,38-39,44-45,48H,11-19,21-24H2,1-2H3
InChIKey: JWRSGOSQCJJHTI-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Voacanga africana | Voacanga | Apocynaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 716.8790000000002
TPSA？: 112.6
MolLogP？: 4.627600000000005
Number of H-Donors: 3
Number of H-Acceptors: 10
RingCount: 11
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|