input word = C00050089

Metabolite InformationStructural formula
Name epi-Norcembrene
Formula C19H24O5
Mw 332.16237388
CAS RN 208259-79-4
C_ID C00050089 ,
InChIKey FDEJGIMXMYCYBJ-VFDDTJPXNA-N
InChICode InChI=1S/C19H24O5/c1-11(2)12-4-5-13-7-15(23-18(13)22)9-19(3)10-16(21)17(24-19)8-14(20)6-12/h7,12,15,17H,1,4-6,8-10H2,2-3H3/t12-,15-,17-,19-/m0/s1
SMILES [C@H]1(CC(=O)C[C@@H]2O[C@](CC2=O)(C[C@@H]2C=C(CC1)C(=O)O2)C)C(=C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Sinularia erecta Ref.
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OrganismSinularia erecta
ReferenceRudi,J.Nat.Prod.,61,(1998),872