input word = C00057947

Metabolite InformationStructural formula
Name Squamosinin A
Formula C36H62O8
Mw 622.44446896
CAS RN 163597-71-5
C_ID C00057947
InChIKey LSLPYJYSYKQINA-UHFFFAOYSA-N
InChICode InChI=1S/C36H62O8/c1-3-4-11-15-28(38)30-17-19-32(42-30)34-21-22-35(44-34)33-20-18-31(43-33)29(39)16-13-10-8-6-5-7-9-12-14-27(37)24-26-23-25(2)41-36(26)40/h23,25,27-35,37-39H,3-22,24H2,1-2H3
SMILES CCCCCC(O)C1CCC(C2CCC(C3CCC(C(O)CCCCCCCCCCC(O)CC4=CC(C)OC4=O)O3)O2)O1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAnnonaceaeAnnona squamosa Ref.
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