input word = C00055301

Metabolite InformationStructural formula
Name Cinnzeylanine
Formula C22H34O8
Mw 426.22536806
CAS RN 62203-47-8
C_ID C00055301
InChIKey DFYFOAFKHRTQLA-PIKMFBPASA-N
InChICode InChI=1S/C22H34O8/c1-11(2)17(24)10-19(26)15(5)9-20(27)16(17,6)22(19,28)21(30-20)14(29-13(4)23)12(3)7-8-18(15,21)25/h11-12,14,24-28H,7-10H2,1-6H3/t12-,14+,15-,16+,17-,18-,19+,20-,21+,22+/m0/s1
SMILES CC([C@@]([C@@]12C)(O)C[C@@]3(O)[C@]([C@@]4(O)CC[C@@H]([C@@H](OC(C)=O)[C@]4(O[C@]25O)[C@@]13O)C)(C5)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLauraceaeCinnamomum cassia Ref.
PlantaeLauraceaeCinnamomum zeylanicum Ref.
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OrganismCinnamomum zeylanicum
ReferenceSrivastava, S.N. et al., Acta Cryst. B, 1970, 26, 707-715 (cryst struct)