(5R,6S,7R,10S)-6-isocyano-7-isopropyl-2,10-dimethylspiro[4.5]dec-1-ene
AlkaPlorer ID: AK355692
Synonym: None
IUPAC Name: (5R,6S,9R,10S)-10-isocyano-3,6-dimethyl-9-propan-2-ylspiro[4.5]dec-3-ene
Structure
SMILES: [C-]#[N+][C@H]1[C@@H](C(C)C)CC[C@H](C)[C@]12C=C(C)CC2
InChI: InChI=1S/C16H25N/c1-11(2)14-7-6-13(4)16(15(14)17-5)9-8-12(3)10-16/h10-11,13-15H,6-9H2,1-4H3/t13-,14+,15-,16-/m0/s1
InChIKey: CLJZNXABBGEKKI-FZKCQIBNSA-N
Reference
Two New Sesquiterpene Isothiocyanates from the Marine Sponge Acanthella klethra
PubChem CID: 44512489
LOTUS: LTS0158440
SuperNatural Ⅲ: SN0048916-05
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Acanthella acuta | Acanthella | Axinellidae | Axinellida | Demospongiae | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 231.383
TPSA？: 4.36
MolLogP？: 4.7028900000000045
Number of H-Donors: 0
Number of H-Acceptors: 0
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|