input word = C00037627

Metabolite InformationStructural formula
Name Phytyl heptadecanoate
Formula C37H72O2
Mw 548.55323154
CAS RN 503002-22-0
C_ID C00037627 ,
InChIKey RPTBIXHQYXEEDC-SONIHIMRNA-N
InChICode InChI=1S/C37H72O2/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-30-37(38)39-32-31-36(6)29-23-28-35(5)27-22-26-34(4)25-21-24-33(2)3/h31,33-35H,7-30,32H2,1-6H3/b36-31+/t34-,35-/m1/s1
SMILES C(CCC[C@H](CCC[C@H](CCC/C(=C/COC(=O)CCCCCCCCCCCCCCCC)/C)C)C)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Simaruba amara Ref.
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