Vobparicine
AlkaPlorer ID: AK395893
Synonym: None
IUPAC Name: methyl (1S,12R,14R,15E,18S)-15-ethylidene-12-[(Z)-[(13R,14E)-14-ethylidene-1,10-diazatetracyclo[11.2.2.03,11.04,9]heptadeca-3(11),4,6,8-tetraen-12-ylidene]methyl]-17-methyl-10,17-diazatetracyclo[12.3.1.03,11.04,9]octadeca-3(11),4,6,8-tetraene-18-carboxylate
Structure
SMILES: C/C=C1/CN2CC[C@H]1/C(=C/[C@H]1C[C@H]3/C(=C\C)CN(C)[C@@H](CC4=C1NC1=CC=CC=C41)[C@H]3C(=O)OC)C1=C(C2)C2=CC=CC=C2N1
InChI: InChI=1S/C39H44N4O2/c1-5-23-20-42(3)35-19-31-27-11-7-9-13-33(27)40-37(31)25(17-29(23)36(35)39(44)45-4)18-30-26-15-16-43(21-24(26)6-2)22-32-28-12-8-10-14-34(28)41-38(30)32/h5-14,18,25-26,29,35-36,40-41H,15-17,19-22H2,1-4H3/b23-5-,24-6-,30-18-/t25-,26-,29+,35+,36+/m1/s1
InChIKey: HAQRVKGZOXRLGV-PAEWDFIFSA-N
Reference
Antimicrobially Active Alkaloids from Tabernaemontana chippii
PubChem CID: 119078524
LOTUS: LTS0177682
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Tabernaemontana africana | Tabernaemontana | Apocynaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 600.8070000000002
TPSA？: 64.36000000000001
MolLogP？: 7.210100000000008
Number of H-Donors: 2
Number of H-Acceptors: 4
RingCount: 9
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|