input word = C00017661

Metabolite InformationStructural formula
Name Myrocin C
Formula C20H24O5
Mw 344.16237388
CAS RN 113122-50-2
C_ID C00017661 ,
InChIKey XMHQAXCZBRHGFM-UHFFFAOYNA-N
InChICode InChI=1S/C20H24O5/c1-4-16(2)7-8-19(23)12(10-16)13(21)20(24)14-17(3,15(22)25-20)6-5-11-9-18(11,14)19/h4,10-11,14,23-24H,1,5-9H2,2-3H3/t11-,14+,16+,17-,18-,19+,20-/m1/s1
SMILES C1C[C@@]2([C@H]3[C@@]4([C@H]1C4)[C@]1(C(=C[C@@](CC1)(C)C=C)C(=O)[C@]3(OC2=O)O)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiIncertae sedisMyrothecium verrucaria No. 55 (FERM P-8880) Ref.
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