input word = C00028204

Metabolite InformationStructural formula
Name Discarine E
Formula C28H44N4O4
Mw 500.33625592
CAS RN 98263-18-4
C_ID C00028204 ,
InChIKey ATHPWFKIPWYJNV-FOCLMDBBNA-N
InChICode InChI=1S/C28H44N4O4/c1-9-18(5)22-26(33)29-16-15-20-11-13-21(14-12-20)36-25(17(3)4)23(27(34)30-22)31-28(35)24(32(7)8)19(6)10-2/h11-19,22-25H,9-10H2,1-8H3,(H,29,33)(H,30,34)(H,31,35)/b16-15+/t18-,19-,22+,23+,24+,25-/m0/s1
SMILES CCC(C)C1NC(=O)C(NC(=O)C(C(C)CC)N(C)C)C(C(C)C)Oc2ccc(cc2)/C=C/NC1=O
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr
Organism
Kingdom Family Species Reference
PlantaeRhamnaceaeDiscaria longispina Ref.
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OrganismDiscaria longispina
ReferenceMachado,J.Nat.Prod.,58,(1995),548