input word = C00012994

Metabolite InformationStructural formula
Name [3R-(3alpha,3abeta,5aalpha,7beta,9bbeta)]-3a,4,5,5a,6,7,8,9b-Octahydro-3a,7-dihydroxy-3,5a,9-trimethylnaphtho[1,2-b]furan-2(3H)-one
Formula C15H22O4
Mw 266.15180919
CAS RN 128988-28-3
C_ID C00012994 ,
InChIKey GGJMSNYGRXMJNL-UQNPSKMBNA-N
InChICode InChI=1S/C15H22O4/c1-8-6-10(16)7-14(3)4-5-15(18)9(2)13(17)19-12(15)11(8)14/h9-10,12,16,18H,4-7H2,1-3H3/t9-,10-,12-,14-,15+/m0/s1
SMILES C1[C@]2(C(=C(C[C@@H]1O)C)[C@H]1[C@@](CC2)([C@H](C(=O)O1)C)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeSphaeranthus suaveolens Ref.
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