16-hydroxy-5,14-diazapentacyclo[12.3.3.0¹,¹³.0?,¹².0?,¹¹]icosa-4(12),6,8,10-tetraen-15-one
AlkaPlorer ID: AK254282
Synonym: None
IUPAC Name: (1R,13S,16R)-16-hydroxy-5,14-diazapentacyclo[12.3.3.01,13.04,12.06,11]icosa-4(12),6,8,10-tetraen-15-one
Structure
SMILES: O=C1[C@H](O)C[C@]23CCCN1[C@@H]2C1=C(CC3)NC2=CC=CC=C12
InChI: InChI=1S/C18H20N2O2/c21-14-10-18-7-3-9-20(17(14)22)16(18)15-11-4-1-2-5-12(11)19-13(15)6-8-18/h1-2,4-5,14,16,19,21H,3,6-10H2/t14-,16-,18-/m1/s1
InChIKey: KLYJAYKJNHMFJX-QGPMSJSTSA-N
Reference
Kopsihainanines A and B, two unusual alkaloids from Kopsia hainanensis
PubChem CID: 54590501
LOTUS: LTS0036302
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Kopsia hainanensis | Kopsia | Apocynaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 296.37
TPSA？: 56.33
MolLogP？: 2.528600000000001
Number of H-Donors: 2
Number of H-Acceptors: 2
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|