input word = C00049344

Metabolite InformationStructural formula
Name 17,18-Dehydroclavulone I
(-)-17,18-Dehydroclavulone I
Formula C25H32O7
Mw 444.21480338
CAS RN 221194-77-0
C_ID C00049344 ,
InChIKey VNMUCAJMMSZIGB-QYOJIUIRNA-N
InChICode InChI=1S/C25H32O7/c1-5-6-7-8-9-10-17-25(32-20(3)27)18-16-23(28)22(25)13-11-12-21(31-19(2)26)14-15-24(29)30-4/h6-7,9-13,16,18,21H,5,8,14-15,17H2,1-4H3/b7-6-,10-9-,12-11-,22-13-/t21-,25-/m0/s1
SMILES C1(=O)C=C[C@](/C/1=C\C=C/[C@@H](CCC(=O)OC)OC(=O)C)(C/C=C\C/C=C\CC)OC(=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Clavularia viridis Ref.
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