input word = C00013085

Metabolite InformationStructural formula
Name [5aR-(5aalpha,6alpha,8alpha,9beta,9abeta,9balpha)]-8-(Acetyloxy)-3-[(acetyloxy)methyl]-5,5a,6,7,8,9,9a,9b-octahydro-6,9-dihydroxy-5a,9-dimethylnaphtho[1,2-b]furan-2(4H)-one
Formula C19H26O8
Mw 382.16276781
CAS RN 126005-62-7
C_ID C00013085 ,
InChIKey DZOYBWIJERJQJX-JMDZZOSYNA-N
InChICode InChI=1S/C19H26O8/c1-9(20)25-8-12-11-5-6-18(3)13(22)7-14(26-10(2)21)19(4,24)16(18)15(11)27-17(12)23/h13-16,22,24H,5-8H2,1-4H3/t13-,14+,15+,16-,18+,19-/m1/s1
SMILES C1[C@@H]([C@@]([C@H]2[C@]([C@@H]1O)(CCC1=C(C(=O)O[C@H]21)COC(=O)C)C)(C)O)OC(=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeAchillea fragrantissima Ref.
zoom in