Secamine; 16-Hydroxy, 15,15',20,20'-tetrahydro
AlkaPlorer ID: AK313181
Synonym: 16-Hydroxytetrahydrosecamine
IUPAC Name: None
Structure
SMILES: CCC1CCCN(CCC2=C(C3(C(=O)OC)CCC(O)(C(=O)OC)C4=C(CCN5CCCC(CC)C5)C5=CC=CC=C5N43)NC3=CC=CC=C23)C1
InChI: InChI=1S/C42H56N4O5/c1-5-29-13-11-23-44(27-29)25-19-33-31-15-7-9-17-35(31)43-37(33)41(39(47)50-3)21-22-42(49,40(48)51-4)38-34(32-16-8-10-18-36(32)46(38)41)20-26-45-24-12-14-30(6-2)28-45/h7-10,15-18,29-30,43,49H,5-6,11-14,19-28H2,1-4H3
InChIKey: LVEXDLAWNSAAPB-UHFFFAOYSA-N
Reference
CAS: 88607-52-7
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Aspidosperma excelsum | Aspidosperma | Apocynaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 696.9330000000002
TPSA？: 100.03
MolLogP？: 6.522600000000008
Number of H-Donors: 2
Number of H-Acceptors: 8
RingCount: 7
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|