input word = C00002349

Metabolite InformationStructural formula
Name Lythramine
Formula C29H37NO5
Mw 479.2671733
CAS RN 32420-56-7
C_ID C00002349 ,
InChIKey YODZWLPSGSZPHZ-OYXIFJPGNA-N
InChICode InChI=1S/C29H37NO5/c1-19(31)35-25-11-7-21-9-13-29(33-2)27(15-21)26-14-20(8-12-28(26)32)6-10-24-16-22-4-3-5-23(17-25)30(22)18-34-24/h8-9,12-15,22-25,32H,3-7,10-11,16-18H2,1-2H3/t22-,23-,24+,25+/m1/s1
SMILES c12cc(ccc1O)CC[C@H]1C[C@H]3CCC[C@H](C[C@H](CCc4ccc(c2c4)OC)OC(=O)C)N3CO1
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Lys
Organism
Kingdom Family Species Reference
PlantaeLythraceaeLythrum anceps Ref.
PlantaeLythraceaeLythrum salicaria Ref.
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OrganismLythrum anceps
ReferenceHarborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter31