C00012497 - Pogostemon parviflorus
C_ID C00012497
CAS RN 95930-42-0
Metabolite Parvinolide;[3aS-(3aR*,6E,10aR*)]-3,3a,4,5,8,9,10,10a-Octahydro-2,2,6-trimethyl-10-methylene-2H-cyclonona[b]furan-2-one
Molecular Formula C15H22O2
Organism Pogostemon parviflorus
Kingdom Plantae
Family Labiatae
Genus Pogostemon
SMILES C1[C@H]2[C@@H](C(=C)CC/C=C(\\C1)/C)OC(=O)C2(C)C
InChI InChI=1S/C15H22O2/c1-10-6-5-7-11(2)13-12(9-8-10)15(3,4)14(16)17-13/h6,12-13H,2,5,7-9H2,1,3-4H3/b10-6-/t12-,13+/m0/s1
InChIKey BNBYFIXJHNFSPY-POHAHGRENA-N
Reference Nanda,Phytochem.,24,(1985),2735
Structural formula image