4-Amino-11-gorgonene; (4α,6α)-form, 4-Isothiocyanate
AlkaPlorer ID: AK285507
Synonym: 4-Isothiocyanato-11-gorgonene
IUPAC Name: 5-isothiocyanato-5,8a-dimethyl-4-prop-1-en-2-yl-1,2,3,4,4a,6,7,8-octahydronaphthalene
Structure
SMILES: C=C(C)C1CCCC2(C)CCCC(C)(N=C=S)C12
InChI: InChI=1S/C16H25NS/c1-12(2)13-7-5-8-15(3)9-6-10-16(4,14(13)15)17-11-18/h13-14H,1,5-10H2,2-4H3
InChIKey: IGNSGVFKUWXKBI-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Phyllidia | Phyllidiidae | Nudibranchia | Gastropoda | Mollusca | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 263.44999999999993
TPSA？: 12.36
MolLogP？: 5.030500000000005
Number of H-Donors: 0
Number of H-Acceptors: 2
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|