input word = C00044087

Metabolite InformationStructural formula
Name Annopentocin A
(+)-Annopentocin A
Formula C35H64O8
Mw 612.46011902
CAS RN 184093-44-5
C_ID C00044087 ,
InChIKey ZPRYGZNEAVBQEP-NHDYHHRQNA-N
InChICode InChI=1S/C35H64O8/c1-3-4-5-6-7-8-9-10-11-15-18-31(38)32(39)20-21-33(40)34-22-19-30(43-34)25-29(37)17-14-12-13-16-28(36)24-27-23-26(2)42-35(27)41/h23,26,28-34,36-40H,3-22,24-25H2,1-2H3/t26-,28+,29+,30+,31+,32+,33-,34-/m0/s1
SMILES C1=C(C(=O)O[C@H]1C)C[C@@H](CCCCC[C@H](C[C@H]1CC[C@H](O1)[C@H](CC[C@H]([C@@H](CCCCCCCCCCCC)O)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAnnonaceaeAnnona muricata Ref.
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OrganismAnnona muricata
ReferenceZafra-Polo,Phytochem.,48,(1998),1087