(2E)-N-[(3R,4R,7S)-7-[(2S)-butan-2-yl]-5,8-dioxo-3-phenyl-2-oxa-6,9-diazabicyclo[10.2.2]hexadeca-1(14),10,12,15-tetraen-4-yl]-3-phenylprop-2-enamide
AlkaPlorer ID: AK089863
Synonym: None
IUPAC Name: (E)-N-[(7S,10E)-7-[(2R)-butan-2-yl]-5,8-dioxo-3-phenyl-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@@H](C)[C@@H]1N=C(O)C(N=C(O)/C=C/C2=CC=CC=C2)C(C2=CC=CC=C2)OC2=CC=C(/C=C/N=C1O)C=C2
InChI: InChI=1S/C32H33N3O4/c1-3-22(2)28-31(37)33-21-20-24-14-17-26(18-15-24)39-30(25-12-8-5-9-13-25)29(32(38)35-28)34-27(36)19-16-23-10-6-4-7-11-23/h4-22,28-30H,3H2,1-2H3,(H,33,37)(H,34,36)(H,35,38)/b19-16+,21-20+/t22-,28+,29?,30?/m1/s1
InChIKey: IEOKZWRWGLHTGX-UASCFIIASA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Scutia buxifolia | Scutia | Rhamnaceae | Rosales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 523.6330000000003
TPSA？: 107.0
MolLogP？: 7.157200000000008
Number of H-Donors: 3
Number of H-Acceptors: 4
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|