C-9154
AlkaPlorer ID: AK319571
Synonym: None
IUPAC Name: (E)-N'-(2-phenylacetyl)but-2-enediamide
Structure
SMILES: NC(=O)/C=C/C(=O)NC(=O)CC1=CC=CC=C1
InChI: InChI=1S/C12H12N2O3/c13-10(15)6-7-11(16)14-12(17)8-9-4-2-1-3-5-9/h1-7H,8H2,(H2,13,15)(H,14,16,17)/b7-6+
InChIKey: RPPKWABVORYKHA-VOTSOKGWSA-N
Reference
PubChem CID: 5970690
CAS: 57687-92-0
LOTUS: LTS0255638
SuperNatural Ⅲ: SN0331796-01
NPASS: NPC271586
{NPAtlas: NPA012043
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Rubus alceifolius | Rubus | Rosaceae | Rosales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 232.239
TPSA？: 89.25999999999999
MolLogP？: -0.0865999999999995
Number of H-Donors: 2
Number of H-Acceptors: 3
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|