input word = C00036779

Metabolite InformationStructural formula
Name Atranone E
(-)-Atranone E
Formula C24H34O4
Mw 386.24570957
CAS RN 227597-65-1
C_ID C00036779 ,
InChIKey CCMBGMOYVQDEBC-WGJBKQRFNA-N
InChICode InChI=1S/C24H34O4/c1-13(2)17-12-20(26)24(6)10-9-15(4)22-18(11-14(3)7-8-19(17)24)21(16(5)25)23(27)28-22/h11-13,16,18-19,21,25H,7-10H2,1-6H3/b14-11+,22-15+/t16-,18+,19+,21-,24?/m0/s1
SMILES C/C1=C[C@@H]2/C(=C(/C)CC[C@]3(C)C(=O)C=C(C(C)C)[C@H]3CC1)OC(=O)[C@H]2[C@H](C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Stachybotrys chartarum Ref.
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