(2E)-N-{3-[(2E)-3-(3,4-dihydroxyphenyl)-N-{4-[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enamido]butyl}prop-2-enamido]propyl}-3-(4-hydroxy-3-methoxyphenyl)prop-2-enamide
AlkaPlorer ID: AK206257
Synonym: None
IUPAC Name: 3-(3,4-dihydroxyphenyl)-N-[4-[3-(3,4-dihydroxyphenyl)prop-2-enoyl-[3-[3-(4-hydroxy-3-methoxyphenyl)prop-2-enoylamino]propyl]amino]butyl]prop-2-enamide
Structure
SMILES: COC1=CC(C=CC(O)=NCCCN(CCCCN=C(O)C=CC2=CC=C(O)C(O)=C2)C(=O)C=CC2=CC=C(O)C(O)=C2)=CC=C1O
InChI: InChI=1S/C35H39N3O9/c1-47-32-23-26(7-13-29(32)41)9-15-34(45)37-18-4-20-38(35(46)16-10-25-6-12-28(40)31(43)22-25)19-3-2-17-36-33(44)14-8-24-5-11-27(39)30(42)21-24/h5-16,21-23,39-43H,2-4,17-20H2,1H3,(H,36,44)(H,37,45)
InChIKey: QHBPDPDZYJEPGR-UHFFFAOYSA-N
Reference
Minor hydroxycinnamic acid spermidines from pollen of Quercus dentata
PubChem CID: 162998254
LOTUS: LTS0197055
COCONUT: CNP0271791
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Quercus dentata | Quercus | Fagaceae | Fagales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 645.7090000000003
TPSA？: 195.87
MolLogP？: 5.575100000000009
Number of H-Donors: 7
Number of H-Acceptors: 9
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|