N,N'-Bis(3-aminopropyl)-1,4-butanediamine; N1-(4-Hydroxy-3-methoxy-E-cinnamoyl), N5,N14-bis(4-hydroxy-E-cinnamoyl) 

AlkaPlorer ID: AK290679

Synonym: N5,N14-Bis-trans-p-coumaroyl-N1-trans-feruloylspermine, Keayanine C 

IUPAC Name: None

Structure

SMILES: COC1=CC(/C=C/C(=O)NCCCN(CCCCNCCCNC(=O)/C=C/C2=CC=C(O)C=C2)C(=O)/C=C/C2=CC=C(O)C=C2)=CC=C1O

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InChI: InChI=1S/C38H46N4O7/c1-49-35-28-31(10-18-34(35)45)12-20-37(47)41-25-5-27-42(38(48)21-13-30-8-16-33(44)17-9-30)26-3-2-22-39-23-4-24-40-36(46)19-11-29-6-14-32(43)15-7-29/h6-21,28,39,43-45H,2-5,22-27H2,1H3,(H,40,46)(H,41,47)/b19-11+,20-12+,21-13+

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InChIKey: FIZLOLNQIUAGOP-UJXXAHDISA-N

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Reference

CAS: 1033754-25-4

Source

Properties Information

Molecule Weight: 670.8070000000002

TPSA: 160.45999999999998

MolLogP: 4.4630000000000045

Number of H-Donors: 6

Number of H-Acceptors: 8

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information