OGK

(1S,2S)-2-ethyl-1-({[(3aS,4S,6R,7aS)-6-ethyl-1-oxooctahydro-1H-inden-4-yl]carbonyl}amino)cyclopropanecarboxylic acid


Toggle HydrogenToggle Labels

Chemical Component Summary

Name(1S,2S)-2-ethyl-1-({[(3aS,4S,6R,7aS)-6-ethyl-1-oxooctahydro-1H-inden-4-yl]carbonyl}amino)cyclopropanecarboxylic acid
SynonymsCoronatine
Identifiers(1S,2S)-1-[[(3aS,4S,6R,7aS)-6-ethyl-1-oxo-2,3,3a,4,5,6,7,7a-octahydroinden-4-yl]carbonylamino]-2-ethyl-cyclopropane-1-carboxylic acid
FormulaC18 H27 N O4
Molecular Weight321.411
TypeNON-POLYMER
Isomeric SMILESCC[C@@H]1C[C@H]2[C@H](CCC2=O)[C@H](C1)C(=O)N[C@]3(C[C@@H]3CC)C(=O)O
InChIInChI=1S/C18H27NO4/c1-3-10-7-13-12(5-6-15(13)20)14(8-10)16(21)19-18(17(22)23)9-11(18)4-2/h10-14H,3-9H2,1-2H3,(H,19,21)(H,22,23)/t10-,11+,12+,13+,14+,18+/m1/s1
InChIKeyYYTFHRRGIDEJIS-FNEQEMTHSA-N

Chemical Details

Formal Charge0
Atom Count50
Chiral Atom Count6
Bond Count52
Aromatic Bond Count0

Related Resource References

Resource NameReference
PubChem 46912131