Molecule

1-[(5S,6R,7S,10R)-7-isopropyl-2,10-dimethylspiro[4.5]dec-1-en-6-yl]-3,3-dimethylthiourea

AlkaPlorer ID: AK231497

Synonym: None

IUPAC Name: 3-[(5S,6R,9S,10R)-3,6-dimethyl-9-propan-2-ylspiro[4.5]dec-3-en-10-yl]-1,1-dimethylthiourea

Structure

SMILES: CC1=C[C@]2(CC1)[C@H](C)CC[C@@H](C(C)C)[C@H]2N=C(S)N(C)C

InChI: InChI=1S/C18H32N2S/c1-12(2)15-8-7-14(4)18(10-9-13(3)11-18)16(15)19-17(21)20(5)6/h11-12,14-16H,7-10H2,1-6H3,(H,19,21)/t14-,15+,16-,18-/m1/s1

InChIKey: RMJRFNRHHMOKTF-KYHPRHEASA-N

Reference

Axisonitrile-3, axisothiocyanate-3 and axamide-3. Sesquiterpenes with a novel spiro[4,5]decane skeleton from the sponge Axinella cannabina

PubChem CID: 162936360

LOTUS: LTS0109486

SuperNatural Ⅲ: SN0329362-01

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Axinella cannabina	Axinella	Axinellidae	Axinellida	Demospongiae	Porifera	Metazoa	Eukaryota

Properties Information

Molecule Weight: 308.535

TPSA？: 15.6

MolLogP？: 4.631000000000004

Number of H-Donors: 1

Number of H-Acceptors: 1

RingCount: 2

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi