input word = C00021033

Metabolite InformationStructural formula
Name 1alphaH,7alphaH,8alphaH,10betaH-2alpha-Tigloyloxy-4beta,11alpha,13-trihydroxy-pseudoguaian-8,12-olide
Formula C20H30O7
Mw 382.19915331
CAS RN 128529-95-3
C_ID C00021033 ,
InChIKey GNFIFVXADUGFIS-IOAZWCFYNA-N
InChICode InChI=1S/C20H30O7/c1-5-10(2)17(23)26-14-7-15(22)19(4)8-12-13(6-11(3)16(14)19)27-18(24)20(12,25)9-21/h5,11-16,21-22,25H,6-9H2,1-4H3/b10-5+/t11-,12+,13-,14+,15+,16-,19-,20-/m1/s1
SMILES [C@@H]12[C@](C[C@H]3[C@@H](C[C@H]1C)OC(=O)[C@]3(CO)O)([C@H](C[C@@H]2OC(=O)/C(=C/C)/C)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeHymenoxys lemmonii Ref.
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