input word = C00044992

Metabolite InformationStructural formula
Name Pachyclavulariolide P
(-)-Pachyclavulariolide P
Formula C20H28O5
Mw 348.193674
CAS RN 551938-79-5
C_ID C00044992 ,
InChIKey RVBQDBFIFUYZKG-OBCOEKRFNA-N
InChICode InChI=1S/C20H28O5/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/h6,12,15,17-18,22H,5,7-10H2,1-4H3/b11-6+/t12-,15-,17-,18+,20-/m0/s1
SMILES CC1=C2C(=O)C/C(C)=C/CC[C@H](C)[C@@H]3CC[C@](C)(O3)[C@H](O)[C@H]2OC1=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Pachyclavularia violacea Ref.
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