Presecamine
AlkaPlorer ID: AK103791
Synonym: None
IUPAC Name: dimethyl 4a-[2-(5-ethyl-3,6-dihydro-2H-pyridin-1-yl)ethyl]-4-[3-[2-(5-ethyl-3,6-dihydro-2H-pyridin-1-yl)ethyl]-1H-indol-2-yl]-3,9-dihydro-2H-carbazole-1,4-dicarboxylate
Structure
SMILES: CCC1=CCCN(CCC2=C(C3(C(=O)OC)CCC(C(=O)OC)=C4NC5=CC=CC=C5C43CCN3CCC=C(CC)C3)NC3=CC=CC=C23)C1
InChI: InChI=1S/C42H52N4O4/c1-5-29-13-11-23-45(27-29)25-20-32-31-15-7-9-17-35(31)43-37(32)42(40(48)50-4)21-19-33(39(47)49-3)38-41(42,34-16-8-10-18-36(34)44-38)22-26-46-24-12-14-30(6-2)28-46/h7-10,13-18,43-44H,5-6,11-12,19-28H2,1-4H3
InChIKey: IJKLSVUPUZOKCH-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Rhazya stricta | Rhazya | Apocynaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 676.902
TPSA？: 86.9
MolLogP？: 7.179900000000008
Number of H-Donors: 2
Number of H-Acceptors: 7
RingCount: 7
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|