input word = C00047667

Metabolite InformationStructural formula
Name 4-Acetoxy-5-brasilene
Formula C17H28O2
Mw 264.20893014
CAS RN 1187303-30-5
C_ID C00047667 ,
InChIKey CUSVAEBRYUBFQZ-JARBORPYNA-N
InChICode InChI=1S/C17H28O2/c1-10(2)15-13-8-7-11(3)14(13)9-17(5,6)16(15)19-12(4)18/h10-11,14,16H,7-9H2,1-6H3/t11-,14+,16-/m1/s1
SMILES [C@@H]1(C(C[C@@H]2C(=C1C(C)C)CC[C@H]2C)(C)C)OC(=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
AnimaliaAplysiidaeAplysia fasciata Ref.
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