input word = C00044174

Metabolite InformationStructural formula
Name Gigantetrocin A
Formula C35H64O7
Mw 596.4652044
CAS RN 160399-32-6
C_ID C00044174 ,
InChIKey VFRBLIGIRLWBKM-KYOWNTFHNA-N
InChICode InChI=1S/C35H64O7/c1-3-4-5-6-7-8-9-10-11-12-13-17-20-31(37)32(38)22-23-33(39)34-24-21-30(42-34)19-16-14-15-18-29(36)26-28-25-27(2)41-35(28)40/h25,27,29-34,36-39H,3-24,26H2,1-2H3/t27-,29+,30+,31+,32+,33-,34-/m0/s1
SMILES CCCCCCCCCCCCCC[C@@H](O)[C@H](O)CC[C@H](O)[C@@H]1CC[C@@H](CCCCC[C@@H](O)CC2=C[C@H](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.