input word = C00051537

Metabolite InformationStructural formula
Name Merresectine C
Formula C25H35NO3
Mw 397.26169399
CAS RN 862587-66-4
C_ID C00051537
InChIKey MYEROKWORYNFGZ-JKHIJQBDNA-N
InChICode InChI=1/C25H35NO3/c1-16(2)6-8-18-12-20(13-19(24(18)27)9-7-17(3)4)25(28)29-23-14-21-10-11-22(15-23)26(21)5/h6-7,12-13,21-23,27H,8-11,14-15H2,1-5H3/t21-,22+,23+
SMILES CC(C)=CCc1cc(C(=O)O[C@H]2C[C@H]3CC[C@@H](C2)N3C)cc(CC=C(C)C)c1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeConvolvulaceaeMerremia dissecta Ref.
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