Lahadinine A
AlkaPlorer ID: AK303918
Synonym: None
IUPAC Name: dimethyl 24-cyano-21-hydroxy-5,7-dioxa-2,15-diazaheptacyclo[17.2.2.112,15.01,12.03,11.04,8.019,24]tetracosa-3(11),4(8),9-triene-2,21-dicarboxylate
Structure
SMILES: COC(=O)N1C2=C3OCOC3=CC=C2C23CCN4CCCC5(CCC12C(O)(C(=O)OC)C5)C43C#N
InChI: InChI=1S/C25H27N3O7/c1-32-19(29)23(31)12-21-6-3-10-27-11-9-22(25(21,27)13-26)15-4-5-16-18(35-14-34-16)17(15)28(20(30)33-2)24(22,23)8-7-21/h4-5,31H,3,6-12,14H2,1-2H3
InChIKey: OMNHQSXKYMYLGD-UHFFFAOYSA-N
Reference
CAS: 200053-18-5
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Kopsia pauciflora | Kopsia | Apocynaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 481.5050000000005
TPSA？: 121.56
MolLogP？: 1.82818
Number of H-Donors: 1
Number of H-Acceptors: 9
RingCount: 8
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|