Salarin A; 16,17-Deepoxy, 17ξ-chloro, 16β-hydroxy
AlkaPlorer ID: AK312812
Synonym: Salarin G
IUPAC Name: [6-[11-acetyl-2-(acetylcarbamoyloxy)-14-methyl-5,10,12-trioxo-4,18-dioxa-11-azabicyclo[15.1.0]octadeca-6,8,13-trien-3-yl]-5-chloro-6-hydroxyhex-3-enyl] octanoate
Structure
SMILES: CCCCCCCC(=O)OCCC=CC(Cl)C(O)C1OC(=O)C=CC=CC(=O)N(C(C)=O)C(=O)C=C(C)CCC2OC2C1OC(=O)NC(C)=O
InChI: InChI=1S/C35H47ClN2O12/c1-5-6-7-8-9-16-29(43)47-20-13-12-14-25(36)31(45)33-34(50-35(46)37-23(3)39)32-26(48-32)19-18-22(2)21-28(42)38(24(4)40)27(41)15-10-11-17-30(44)49-33/h10-12,14-15,17,21,25-26,31-34,45H,5-9,13,16,18-20H2,1-4H3,(H,37,39,46)
InChIKey: CJRQBWUJJJGIOX-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Fascaplysinopsis | Thorectidae | Dictyoceratida | Demospongiae | Porifera | Metazoa | Eukaryota |
| None | Fascaplysinopsis | Thorectidae | Dictyoceratida | Demospongiae | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 723.2160000000001
TPSA?: 195.21
MolLogP?: 3.879400000000002
Number of H-Donors: 2
Number of H-Acceptors: 12
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|
