input word = C00044176

Metabolite InformationStructural formula
Name Gigantetronenin
Formula C37H66O7
Mw 622.48085446
CAS RN 145403-31-2
C_ID C00044176 ,
InChIKey LFIZQGRMDGWRQH-CCEZHUSRNA-N
InChICode InChI=1S/C37H66O7/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-19-22-33(39)34(40)24-25-35(41)36-26-23-32(44-36)21-18-16-17-20-31(38)28-30-27-29(2)43-37(30)42/h14-15,27,29,31-36,38-41H,3-13,16-26,28H2,1-2H3/b15-14+/t29-,31+,32-,33-,34-,35-,36-/m0/s1
SMILES CCCCCCCCCCCC/C=C/CCC(O)C(O)CCC(O)C1CCC(CCCCCC(O)CC2=CC(C)OC2=O)O1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAnnonaceaeAnnona glabra Ref.
PlantaeAnnonaceaeAnnona muricata Ref.
PlantaeAnnonaceaeGoniothalamus giganteus Ref.
PlantaeAnnonaceaeXylopia aromatica Ref.
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OrganismXylopia aromatica
ReferenceMoreira, I. C. et al., Chem. Biodiv., 10, (2013), 1921-1943.