input word = C00055207

Metabolite InformationStructural formula
Name Arnidenediol
Formula C30H50O2
Mw 442.38108084
CAS RN 6750-30-7
C_ID C00055207
InChIKey IOPDFSGGBHSXSV-IMLFCHQCSA-N
InChICode InChI=1S/C30H50O2/c1-18-11-14-28(6)24(32)17-30(8)20(25(28)19(18)2)9-10-22-27(5)15-13-23(31)26(3,4)21(27)12-16-29(22,30)7/h19-25,31-32H,1,9-17H2,2-8H3/t19-,20-,21+,22-,23+,24+,25-,27+,28-,29-,30-/m1/s1
SMILES CC1(C)[C@@H](O)CC[C@]2(C)[C@@]([C@@]3(C)CC[C@]21[H])([H])CC[C@]([C@@]3(C)C[C@@H]4O)([H])[C@@]([C@]4(C)CC5)([H])[C@H](C)C5=C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeTaraxacum officinale Ref.
zoom in