input word = C00049051

Metabolite InformationStructural formula
Name Longithorone J
Formula C21H30O2
Mw 314.2245802
CAS RN 219476-96-7
C_ID C00049051 ,
InChIKey DFVHKIYTXPDJJK-RGNAKBDXNA-N
InChICode InChI=1S/C21H30O2/c1-15-6-4-8-16(2)10-11-18-13-21(23)19(14-20(18)22)12-17(3)9-5-7-15/h6,9-10,13,19,21,23H,4-5,7-8,11-12,14H2,1-3H3/b15-6+,16-10+,17-9-/t19-,21-/m0/s1
SMILES C1=C2C/C=C(/CC/C=C(/CC/C=C(\C[C@H]([C@H]1O)CC2=O)/C)\C)\C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
AnimaliaPolyclinidaeAplidium longithorax Ref.
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