Cavernothiocyanate
AlkaPlorer ID: AK291838
Synonym: 12-Thiocyanato-7(11)-oppositene
IUPAC Name: None
Structure
SMILES: C/C(=C/C1CCC2(C)CCCC(C)C12)CSC#N
InChI: InChI=1S/C16H25NS/c1-12(10-18-11-17)9-14-6-8-16(3)7-4-5-13(2)15(14)16/h9,13-15H,4-8,10H2,1-3H3/b12-9-
InChIKey: DHYDUAYOJJKGRC-XFXZXTDPSA-N
Reference
CAS: 145543-57-3
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Acanthella | Melastomataceae | Myrtales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Phyllidia ocellata | Phyllidia | Phyllidiidae | Nudibranchia | Gastropoda | Mollusca | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 263.45
TPSA？: 23.79
MolLogP？: 4.999480000000005
Number of H-Donors: 0
Number of H-Acceptors: 2
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|