input word = C00044993

Metabolite InformationStructural formula
Name Pachyclavulariolide Q
(+)-Pachyclavulariolide Q
Formula C20H30O5
Mw 350.20932407
CAS RN 551938-80-8
C_ID C00044993 ,
InChIKey UWAIXFGHQNPRSB-OJLQUOIINA-N
InChICode InChI=1S/C20H30O5/c1-11-6-5-7-12(2)15-8-9-20(4,25-15)18(22)17-16(14(21)10-11)13(3)19(23)24-17/h6,12-13,15-18,22H,5,7-10H2,1-4H3/b11-6+/t12-,13+,15-,16-,17-,18+,20-/m0/s1
SMILES C/C1=CCC[C@H](C)[C@@H]2CC[C@](C)(O2)[C@H](O)[C@H]2OC(=O)[C@H](C)[C@H]2C(=O)C1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Pachyclavularia violacea Ref.
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