N1-(3,4-dihydroxybenzoyl)-N8-citryl-spermidine

<i>N</i><sup>1</sup>-(3,4-dihydroxybenzoyl)-<i>N</i><sup>8</sup>-citryl-spermidine




Chemical Formula:
C20H28N3O9
Molecular Weight:
454.456 Daltons
Monoisotopic Mass:
456.19820457750006 Daltons
SMILES:
C([N+]CCCCNC(=O)CC(C(=O)[O-])(O)CC(=O)[O-])CCNC(C1(C=CC(O)=C(O)C=1))=O
InChI:
1S/C20H29N3O9/c24-14-5-4-13(10-15(14)25)18(29)23-9-3-7-21-6-1-2-8-22-16(26)11-20(32,19(30)31)12-17(27)28/h4-5,10,21,24-25,32H,1-3,6-9,11-12H2,(H,22,26)(H,23,29)(H,27,28)(H,30,31)/p-1
InChIKey:
FXIUYHSBLDKCJD-UHFFFAOYSA-M

Synonyms
  • 3,4-dihydroxybenzoate-spermidine-citrate
  • DHB-spermidine-citrate
  • 3,4-dihydroxybenzoyl-citryl-spermidine

Databases
MetaCyc:  CPD-11477
PubChem (CID):  44237131
MetaNetX:  MNXM12409