(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-hydroxyphenyl)prop-2-enamide
AlkaPlorer ID: AK175648
Synonym: None
IUPAC Name: N-[3-[3-(3,4-dihydroxyphenyl)prop-2-enoyl-[4-[3-(3,4-dihydroxyphenyl)prop-2-enoylamino]butyl]amino]propyl]-3-(4-hydroxyphenyl)prop-2-enamide
Structure
SMILES: O=C(C=CC1=CC=C(O)C(O)=C1)N(CCCCN=C(O)C=CC1=CC=C(O)C(O)=C1)CCCN=C(O)C=CC1=CC=C(O)C=C1
InChI: InChI=1S/C34H37N3O8/c38-27-11-4-24(5-12-27)8-15-32(43)36-19-3-21-37(34(45)17-10-26-7-14-29(40)31(42)23-26)20-2-1-18-35-33(44)16-9-25-6-13-28(39)30(41)22-25/h4-17,22-23,38-42H,1-3,18-21H2,(H,35,44)(H,36,43)
InChIKey: XYBWBOHZMFLRBQ-UHFFFAOYSA-N
Reference
Trisubstituted hydroxycinnamic acid spermidines from Quercus dentata pollen
PubChem CID: 73189942
LOTUS: LTS0254577
COCONUT: CNP0267661
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Quercus dentata | Quercus | Fagaceae | Fagales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 615.6830000000003
TPSA？: 186.64
MolLogP？: 5.566500000000007
Number of H-Donors: 7
Number of H-Acceptors: 8
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|