input word = C00012992

Metabolite InformationStructural formula
Name [3aR-(3aalpha,5abeta,7alpha,9balpha)]-3a,4,5,5a,6,7,8,9b-Octahydro-3a,7-dihydroxy-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one
Formula C15H20O4
Mw 264.13615913
CAS RN 128988-26-1
C_ID C00012992 ,
InChIKey QMDOXPAVXVTWGC-SZDKTXNJNA-N
InChICode InChI=1S/C15H20O4/c1-8-6-10(16)7-14(3)4-5-15(18)9(2)13(17)19-12(15)11(8)14/h10,12,16,18H,2,4-7H2,1,3H3/t10-,12-,14-,15+/m0/s1
SMILES C1[C@]2(C(=C(C[C@@H]1O)C)[C@H]1[C@@](CC2)(C(=C)C(=O)O1)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeSphaeranthus suaveolens Ref.
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