input word = C00021800

Metabolite InformationStructural formula
Name Pentalenic acid
Formula C15H22O3
Mw 250.15689457
CAS RN 69394-19-0
C_ID C00021800 ,
InChIKey WBLTVUMJMJIOGQ-ITHMKRPFNA-N
InChICode InChI=1S/C15H22O3/c1-8-4-5-10-9(13(17)18)6-11-12(16)14(2,3)7-15(8,10)11/h6,8,10-12,16H,4-5,7H2,1-3H3,(H,17,18)/t8-,10+,11-,12-,15+/m1/s1
SMILES [C@@H]1(C(C[C@@]23[C@@H]1C=C([C@@H]2CC[C@H]3C)C(=O)O)(C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces spp. Ref.
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