Molecule

stemocochinin

AlkaPlorer ID: AK049491

Synonym: None

IUPAC Name: (2S)-4-methyl-2-[(1S,2R,3S,4S,6R,11S)-3-methyl-11-[(2S,4S)-4-methyl-5-oxooxolan-2-yl]-5-oxa-10-azatricyclo[8.3.0.02,6]tridecan-4-yl]-2H-furan-5-one

Structure

SMILES: CC1=C[C@@H]([C@H]2O[C@@H]3CCCN4[C@@H](CC[C@H]4[C@@H]4C[C@H](C)C(=O)O4)[C@H]3[C@@H]2C)OC1=O

InChI: InChI=1S/C22H31NO5/c1-11-9-17(27-21(11)24)14-6-7-15-19-13(3)20(18-10-12(2)22(25)28-18)26-16(19)5-4-8-23(14)15/h10-11,13-20H,4-9H2,1-3H3/t11-,13-,14-,15-,16+,17-,18-,19+,20-/m0/s1

InChIKey: QAAYWVNRGVTWRB-URHJFWJQSA-N

Reference

Alkaloids from Stems and Leaves of<i>Stemona japonica</i>and Their Insecticidal Activities

PubChem CID: 163089575

LOTUS: LTS0107691

SuperNatural Ⅲ: SN0299744-02

NPASS: NPC131890

data_source: manually

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Crinodendron patagua	Crinodendron	Elaeocarpaceae	Oxalidales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Brosimum acutifolium	Brosimum	Moraceae	Rosales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Turbinellus kauffmanii	Turbinellus	Gomphaceae	Gomphales	Agaricomycetes	Basidiomycota	Fungi	Eukaryota
Thyrsanthera suborbicularis	Thyrsanthera	Euphorbiaceae	Malpighiales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota

Properties Information

Molecule Weight: 389.4920000000002

TPSA？: 65.07

MolLogP？: 2.4562

Number of H-Donors: 0

Number of H-Acceptors: 6

RingCount: 5

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi