input word = C00016765

Metabolite InformationStructural formula
Name Cyclooctatin
Formula C20H34O3
Mw 322.25079495
CAS RN 139552-97-9
C_ID C00016765 ,
InChIKey MSKFOQCDNOFJAT-SOFYXZRVNA-N
InChICode InChI=1S/C20H34O3/c1-12(2)14-5-7-19(3)10-15-13(11-21)9-17(22)18(15)20(4,23)8-6-16(14)19/h6,12-15,17-18,21-23H,5,7-11H2,1-4H3/b16-6-/t13-,14+,15-,17-,18-,19+,20+/m0/s1
SMILES [C@]1([C@H]2[C@@H](C[C@@]3(C(=CC1)[C@H](CC3)C(C)C)C)[C@@H](C[C@@H]2O)CO)(O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces melanosporofaciens MI614-43F2 Ref.
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