input word = C00050655

Metabolite InformationStructural formula
Name 2,4-cis-Isoannonareticin
Formula C37H66O7
Mw 622.48085446
CAS RN 175673-59-3
C_ID C00050655
InChIKey ZHVXTQBKYIOKFC-YWAYEFESNA-N
InChICode InChI=1S/C37H66O7/c1-3-4-5-6-7-11-14-17-20-31(39)33-22-24-35(43-33)36-25-23-34(44-36)32(40)21-18-15-12-9-8-10-13-16-19-30(38)27-29-26-28(2)42-37(29)41/h28-29,31-36,39-40H,3-27H2,1-2H3/t28-,29-,31-,32+,33+,34+,35+,36+/m0/s1
SMILES CCCCCCCCCC[C@H](O)[C@H]1CC[C@H]([C@H]2CC[C@H]([C@H](O)CCCCCCCCCCC(=O)CC3C[C@H](C)OC3=O)O2)O1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAnnonaceaeAnnona reticulata Ref.
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