(2E)-N-[(3S,4R,7R)-3-isopropyl-7-(2-methylpropyl)-5,8-dioxo-2-oxa-6,9-diazabicyclo[10.2.2]hexadeca-1(14),10,12,15-tetraen-4-yl]-3-phenylprop-2-enamide
AlkaPlorer ID: AK318749
Synonym: None
IUPAC Name: (E)-N-[(10E)-7-(2-methylpropyl)-5,8-dioxo-3-propan-2-yl-2-oxa-6,9-diazabicyclo[10.2.2]hexadeca-1(14),10,12,15-tetraen-4-yl]-3-phenylprop-2-enamide
Structure
SMILES: CC(C)CC1N=C(O)C(N=C(O)/C=C/C2=CC=CC=C2)C(C(C)C)OC2=CC=C(/C=C/N=C1O)C=C2
InChI: InChI=1S/C29H35N3O4/c1-19(2)18-24-28(34)30-17-16-22-10-13-23(14-11-22)36-27(20(3)4)26(29(35)31-24)32-25(33)15-12-21-8-6-5-7-9-21/h5-17,19-20,24,26-27H,18H2,1-4H3,(H,30,34)(H,31,35)(H,32,33)/b15-12+,17-16+
InChIKey: PIKYWSMFUHQKOS-PYWSDYSGSA-N
Reference
Cyclic peptide and peptide alkaloids from seeds ofZizyphus vulgaris
PubChem CID: 14729078
LOTUS: LTS0235679
NPASS: NPC166088
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Ziziphus jujuba | Ziziphus | Rhamnaceae | Rosales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 489.6160000000002
TPSA？: 107.0
MolLogP？: 6.440500000000006
Number of H-Donors: 3
Number of H-Acceptors: 4
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|