input word = C00044131

Metabolite InformationStructural formula
Name Coriacin
(+)-Coriacin
Formula C37H66O7
Mw 622.48085446
CAS RN 181221-76-1
C_ID C00044131 ,
InChIKey LGOXIUCRKMEOAH-WLULEYCPNA-N
InChICode InChI=1S/C37H66O7/c1-3-4-5-6-7-8-9-10-11-17-22-33(39)34(40)23-18-12-13-19-24-35(41)36-26-25-32(44-36)21-16-14-15-20-31(38)28-30-27-29(2)43-37(30)42/h12-13,27,29,31-36,38-41H,3-11,14-26,28H2,1-2H3/b13-12-/t29-,31-,32-,33+,34-,35+,36+/m0/s1
SMILES C1(=C[C@@H](OC1=O)C)C[C@@H](O)CCCCC[C@H]1CC[C@@H](O1)[C@@H](CC/C=C\CC[C@H](O)[C@@H](CCCCCCCCCCCC)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAnnonaceaeAnnona coriacea Ref.
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OrganismAnnona coriacea
ReferenceZafra-Polo,Phytochem.,48,(1998),1087