input word = C00057246

Metabolite InformationStructural formula
Name 15-Palmitoylsolamin
Formula C51H94O6
Mw 802.70504073
CAS RN 213313-60-1
C_ID C00057246
InChIKey GBSUIQLRRKMVMZ-ZZFOEEQVSA-N
InChICode InChI=1S/C51H94O6/c1-4-6-8-10-12-14-16-17-18-24-28-32-36-40-50(53)57-48(39-35-31-27-23-20-19-21-25-29-33-37-45-43-44(3)55-51(45)54)49-42-41-47(56-49)46(52)38-34-30-26-22-15-13-11-9-7-5-2/h43-44,46-49,52H,4-42H2,1-3H3/t44-,46+,47+,48+,49+/m0/s1
SMILES CCCCCCCCCCCCCCCC(=O)O[C@H](CCCCCCCCCCCCC1=C[C@H](C)OC1=O)[C@H]1CC[C@H]([C@H](O)CCCCCCCCCCCC)O1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAnnonaceaeAnnona muricata Ref.
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