input word = C00048645

Metabolite InformationStructural formula
Name Cespihypotin Q
(-)-Cespihypotin Q
Formula C22H34O4
Mw 362.24570957
CAS RN 1114544-84-1
C_ID C00048645 ,
InChIKey XFWZSUKBNFVIMQ-SPEDYVCMNA-N
InChICode InChI=1S/C22H34O4/c1-14-7-8-16-9-10-18-19(21(16,3)4)22(25-6,26-20(18)24-5)13-15(2)12-17(23)11-14/h12,16-17,20,23H,1,7-11,13H2,2-6H3/b15-12+/t16-,17+,20-,22-/m1/s1
SMILES C12=C3C([C@@H](CC1)CCC(=C)C[C@@H](/C=C(/C[C@]3(O[C@H]2OC)OC)\C)O)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
AnimaliaXeniidaeCespitularia hypotentaculata Ref.
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OrganismCespitularia hypotentaculata
ReferenceBlunt,Nat.Prod.Rep.,27,(2010),165