4-(1,2,3,10,11,11a-Hexahydro-5-oxo-5H-pyrrolo[2,1-c][1,4]benzodiazepin-11-ylidene)-3-oxobutanoic acid; (S)-(Z)-form
AlkaPlorer ID: AK300344
Synonym: None
IUPAC Name: (4Z)-3-oxo-4-(11-oxo-6a,7,8,9-tetrahydro-5H-pyrrolo[2,1-c][1,4]benzodiazepin-6-ylidene)butanoic acid
Structure
SMILES: O=C(O)CC(=O)/C=C1\NC2=CC=CC=C2C(=O)N2CCCC12
InChI: InChI=1S/C16H16N2O4/c19-10(9-15(20)21)8-13-14-6-3-7-18(14)16(22)11-4-1-2-5-12(11)17-13/h1-2,4-5,8,14,17H,3,6-7,9H2,(H,20,21)/b13-8-
InChIKey: ILVPUOFERZHGNR-JYRVWZFOSA-N
Reference
PubChem CID: 21577074
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Fuligo candida | Fuligo | Physaraceae | Physariida | Eumycetozoa | Evosea | None | Eukaryota |
Properties Information
Molecule Weight: 300.31400000000014
TPSA？: 86.71
MolLogP？: 1.6444000000000003
Number of H-Donors: 2
Number of H-Acceptors: 4
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|