Agelasine A; 8,9-Diepimer, 10β-hydroxy, 3,4β-dihydro
AlkaPlorer ID: AK283532
Synonym: Agelasine N
IUPAC Name: None
Structure
SMILES: C/C(=C\CN1C=[N+](C)C2=NC=NC(N)=C21)CCC1(C)C(C)CCC2(C)C(C)CCCC12O
InChI: InChI=1S/C26H42N5O/c1-18(11-15-31-17-30(6)23-21(31)22(27)28-16-29-23)9-13-24(4)20(3)10-14-25(5)19(2)8-7-12-26(24,25)32/h11,16-17,19-20,32H,7-10,12-15H2,1-6H3,(H2,27,28,29)/q+1/b18-11+
InChIKey: ARGCVWRSHGBYAK-WOJGMQOQSA-N
Reference
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Agelas citrina | Agelas | Agelasidae | Agelasida | Demospongiae | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 440.6560000000003
TPSA？: 80.84
MolLogP？: 4.558100000000005
Number of H-Donors: 2
Number of H-Acceptors: 5
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|