input word = C00017443

Metabolite InformationStructural formula
Name [4S-(4alpha,4aalpha,5alpha,8aalpha,9aalpha)]-4a,5,6,7,8,8a,9,9a-Octahydro-4,8a-dihydroxy-9a-methoxy-3,4a,5-trimethylnaphtho[2,3-b]furan-2(4H)-one
Formula C16H24O5
Mw 296.16237388
CAS RN 130395-63-0
C_ID C00017443 ,
InChIKey PWHROBOFPPCUTQ-PJQBJGGENA-N
InChICode InChI=1S/C16H24O5/c1-9-6-5-7-15(19)8-16(20-4)11(10(2)13(18)21-16)12(17)14(9,15)3/h9,12,17,19H,5-8H2,1-4H3/t9-,12+,14-,15-,16-/m0/s1
SMILES CO[C@]12C[C@@]3(O)CCC[C@H](C)[C@@]3(C)[C@H](O)C1=C(C)C(=O)O2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeHertia cheirifolia Ref.
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