CID 15403302
AlkaPlorer ID: AK083938
Synonym: None
IUPAC Name: None
Structure
SMILES: O=C1C=C2C[C@@H](C(=O)O)N(/C=C/C3=CC(=C([O-])[O-])N[C@H](C(=O)O)C3)C2=CC1=O
InChI: InChI=1S/C18H16N2O8/c21-14-6-9-5-13(18(27)28)20(12(9)7-15(14)22)2-1-8-3-10(16(23)24)19-11(4-8)17(25)26/h1-3,6-7,11,13,19,23-24H,4-5H2,(H,25,26)(H,27,28)/p-2/b2-1+/t11-,13-/m0/s1
InChIKey: PHGYRWDYJWBGFA-WODDMCJRSA-L
Reference
NPASS: NPC164338
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Scutellaria barbata | Scutellaria | Lamiaceae | Lamiales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Portulaca grandiflora | Portulaca | Portulacaceae | Caryophyllales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 386.31600000000014
TPSA？: 170.13
MolLogP？: -2.1162999999999963
Number of H-Donors: 3
Number of H-Acceptors: 8
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|