input word = C00046622

Metabolite InformationStructural formula
Name Asitrocin
(+)-Asitrocin
Formula C35H64O7
Mw 596.4652044
CAS RN 307319-68-2
C_ID C00046622 ,
InChIKey DRFBUADSYRWIKE-JTRUFRAVNA-N
InChICode InChI=1S/C35H64O7/c1-3-4-5-6-7-8-9-10-14-17-20-31(38)33-23-24-34(42-33)32(39)22-21-29(36)18-15-12-11-13-16-19-30(37)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-/m1/s1
SMILES O1[C@@H](C=C(C1=O)C[C@H](O)CCCCCCC[C@H](CC[C@@H]([C@@H]1O[C@@H]([C@@H](CCCCCCCCCCCC)O)CC1)O)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAnnonaceaeAsimina triloba Ref.
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OrganismAsimina triloba
ReferenceKim,J.Nat.Prod.,63,(2000),1503