input word = C00044094

Metabolite InformationStructural formula
Name Aromin
(+)-Aromin
Formula C35H60O7
Mw 592.43390427
CAS RN 174974-30-2
C_ID C00044094 ,
InChIKey WDZXYNFQDMBPPE-HJTMKMAYNA-N
InChICode InChI=1S/C35H60O7/c1-3-4-5-6-7-8-9-10-11-14-17-31(37)33-21-22-34(42-33)32(38)18-15-12-13-16-28(36)25-30-20-19-29(41-30)24-27-23-26(2)40-35(27)39/h23,26,29-34,37-38H,3-22,24-25H2,1-2H3/t26-,29-,30-,31-,32-,33-,34-/m1/s1
SMILES CCCCCCCCCCCC[C@@H](O)[C@H]1CC[C@H]([C@H](O)CCCCCC(=O)C[C@H]2CC[C@H](CC3=CC(C)OC3=O)O2)O1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAnnonaceaeXylopia aromatica Ref.
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OrganismXylopia aromatica
ReferenceZafra-Polo,Phytochem.,48,(1998),1087