input word = C00043148

Metabolite InformationStructural formula
Name 11beta,12beta-Epoxypukalide
Formula C21H24O7
Mw 388.15220312
CAS RN 95925-22-7
C_ID C00043148 ,
InChIKey QKPWPHBMPBPNMQ-FGOZGOERNA-N
InChICode InChI=1S/C21H24O7/c1-10(2)11-5-6-21-17(28-21)15(26-19(21)23)9-20(3)16(27-20)14-8-12(18(22)24-4)13(7-11)25-14/h8,11,15-17H,1,5-7,9H2,2-4H3/t11-,15+,16+,17+,20-,21+/m0/s1
SMILES C=C(C)[C@H]1CC[C@@]23O[C@@H]2[C@@H](C[C@]2(C)OC2c2cc(C(=O)OC)c(o2)C1)OC3=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Phyllogorgia dilatata Ref.
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OrganismPhyllogorgia dilatata
ReferenceBerlinck,J.Nat.Prod.,67,(2004),510