input word = C00046542

Metabolite InformationStructural formula
Name (2,4)-trans-Asitrocinone
Formula C35H64O7
Mw 596.4652044
CAS RN 307319-76-2
C_ID C00046542 ,
InChIKey FUIXSBBJEDTCNV-DGSIYFCONA-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(37)18-15-12-11-13-16-19-30-26-28(25-27(2)36)35(40)41-30/h28-34,37-39H,3-26H2,1-2H3/t28-,29-,30-,31-,32+,33-,34-/m1/s1
SMILES C1(=O)[C@@H](C[C@H](O1)CCCCCCC[C@@H](O)CC[C@H](O)[C@H]1CC[C@@H](O1)[C@H](O)CCCCCCCCCCCC)CC(=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAnnonaceaeAsimina triloba Ref.
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