input word = C00013084

Metabolite InformationStructural formula
Name [5aR-(5aalpha,6alpha,8alpha,9beta,9abeta,9balpha)]-8-(Acetyloxy)-5,5a,6,7,8,9,9a,9b-octahydro-6,9-dihydroxy-3-(hydroxymethyl)-5a,9-dimethylnaphtho[1,2-b]furan-2(4H)-one
Formula C17H24O7
Mw 340.15220312
CAS RN 126005-61-6
C_ID C00013084 ,
InChIKey MRNKTYBWANEKJO-KCSWHTOGNA-N
InChICode InChI=1S/C17H24O7/c1-8(19)23-12-6-11(20)16(2)5-4-9-10(7-18)15(21)24-13(9)14(16)17(12,3)22/h11-14,18,20,22H,4-7H2,1-3H3/t11-,12+,13+,14-,16+,17-/m1/s1
SMILES C1[C@@H]([C@@]([C@H]2[C@]([C@@H]1O)(CCC1=C(C(=O)O[C@H]21)CO)C)(C)O)OC(=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeAchillea fragrantissima Ref.
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OrganismAchillea fragrantissima
ReferenceAbdel-Mogib,Phytochem.,28,(1989),3528