1,7,7-trimethylbicyclo[2.2.1]heptan-2-yl cyano(sulfanylidene)formate
AlkaPlorer ID: AK096030
Synonym: None
IUPAC Name: (1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl) 2-cyano-2-sulfanylideneacetate
Structure
SMILES: CC1(C)C2CCC1(C)C(OC(=O)C(=S)C#N)C2
InChI: InChI=1S/C13H17NO2S/c1-12(2)8-4-5-13(12,3)10(6-8)16-11(15)9(17)7-14/h8,10H,4-6H2,1-3H3
InChIKey: JMWJGYSYWIJZRH-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Illicium verum | Illicium | Schisandraceae | Austrobaileyales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 251.351
TPSA？: 50.09
MolLogP？: 2.637880000000001
Number of H-Donors: 0
Number of H-Acceptors: 4
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|