input word = C00023681

Metabolite InformationStructural formula
Name Cyathin C3
1,2-Dehydrocyathin B3
Formula C20H26O3
Mw 314.1881947
CAS RN 51727-91-4
C_ID C00023681 ,
InChIKey DGSOCCFUSLXQIF-WWGFTEFTNA-N
InChICode InChI=1S/C20H26O3/c1-12(2)14-5-6-19(3)7-8-20(4)15(18(14)19)10-16(22)13(11-21)9-17(20)23/h5-6,9,11-12,15-16,22H,7-8,10H2,1-4H3/t15-,16-,19-,20-/m1/s1
SMILES [C@@]12([C@@H](C3=C(C=C[C@@]3(CC1)C)C(C)C)C[C@H](C(=CC2=O)C=O)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiNidulariaceaeCyathus helenae Ref.
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OrganismCyathus helenae
ReferenceAyer,Can.J.Chem.,51,(1973),3157-3160