input word = C00061723

Metabolite InformationStructural formula
Name Montanacin H
Formula C35H62O9
Mw 626.43938358
CAS RN 403656-92-8
C_ID C00061723
InChIKey STJJUSLIASGPDV-OTUZRFFLSA-N
InChICode InChI=1S/C35H62O9/c1-3-4-5-6-7-8-9-10-11-12-19-30(39)32-21-22-33(43-32)31(40)20-14-13-16-28(37)24-29(38)18-15-17-27(36)23-26-25-35(2,42)44-34(26)41/h25,27,29-33,36,38-40,42H,3-24H2,1-2H3/t27-,29-,30+,31-,32-,33-,35?/m1/s1
SMILES CCCCCCCCCCCCC(O)C1CCC(C(O)CCCCC(=O)CC(O)CCCC(O)CC2=CC(C)(O)OC2=O)O1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAnnonaceaeAnnona muricata Ref.
zoom in