input word = C00044991

Metabolite InformationStructural formula
Name Pachyclavulariolide O
(-)-Pachyclavulariolide O
Formula C20H30O4
Mw 334.21440945
CAS RN 551938-78-4
C_ID C00044991 ,
InChIKey OFDXQVMWNHHDDC-ZXSMJXHANA-N
InChICode InChI=1S/C20H30O4/c1-12-6-5-7-13(2)16-8-9-20(4,24-16)18(21)11-15-14(3)19(22)23-17(15)10-12/h6,13,16-18,21H,5,7-11H2,1-4H3/b12-6+/t13-,16+,17+,18+,20-/m0/s1
SMILES CC1=C2C[C@@H](O)[C@]3(C)CC[C@@H](O3)[C@@H](C)CC/C=C(C)C[C@H]2OC1=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Pachyclavularia violacea Ref.
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