Agelasidine C; (-)-form, 20-Hydroxy
AlkaPlorer ID: AK283525
Synonym: Agelasidine D
IUPAC Name: 2-[2-[3-(hydroxymethyl)-7-methyl-9-(1,2,6-trimethylcyclohex-2-en-1-yl)nona-2,6-dienyl]sulfonylethyl]guanidine
Structure
SMILES: CC(=CCCC(=CCS(=O)(=O)CCNC(=N)N)CO)CCC1(C)C(C)=CCCC1C
InChI: InChI=1S/C23H41N3O3S/c1-18(11-13-23(4)19(2)8-6-9-20(23)3)7-5-10-21(17-27)12-15-30(28,29)16-14-26-22(24)25/h7-8,12,20,27H,5-6,9-11,13-17H2,1-4H3,(H4,24,25,26)
InChIKey: ZWSGURSNDHDWDQ-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Agelas clathrodes | Agelas | Agelasidae | Agelasida | Demospongiae | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 439.66600000000034
TPSA？: 116.27
MolLogP？: 3.6921700000000026
Number of H-Donors: 4
Number of H-Acceptors: 4
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|