Cordyformamide
AlkaPlorer ID: AK292985
Synonym: [1,4-Bis(3,4-dihydroxyphenyl)-1,3-butadiene-2,3-diyl]diformamide
IUPAC Name: N-[(1Z,3Z)-1,4-bis(3,4-dihydroxyphenyl)-3-formamidobuta-1,3-dien-2-yl]formamide
Structure
SMILES: OC=NC(=C\C1=CC=C(O)C(O)=C1)/C(=C/C1=CC=C(O)C(O)=C1)N=CO
InChI: InChI=1S/C18H16N2O6/c21-9-19-13(5-11-1-3-15(23)17(25)7-11)14(20-10-22)6-12-2-4-16(24)18(26)8-12/h1-10,23-26H,(H,19,21)(H,20,22)/b13-5-,14-6-
InChIKey: KPWLCIMXGXBDGX-GFIWHYBVSA-N
Reference
PubChem CID: 16216157
CAS: 930783-39-4
LOTUS: LTS0009665
SuperNatural Ⅲ: SN0192192-03
NPASS: NPC252817
{NPAtlas: NPA018824
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Cordyceps | Cordycipitaceae | Hypocreales | Sordariomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 356.334
TPSA？: 146.10000000000002
MolLogP？: 3.063600000000002
Number of H-Donors: 6
Number of H-Acceptors: 6
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Chlorocebus sabaeus | Vero | Activity | nan | None | 10.1021/np060509t |
| Homo sapiens | KB | Activity | nan | None | 10.1021/np060509t |
| Plasmodium falciparum | Plasmodium falciparum | IC50 | 18000.0 | nM | 10.1021/np060509t |
| None | ADMET | Activity | nan | None | 10.1021/np060509t |
| None | ADMET | IC50 | 39000.0 | nM | 10.1021/np060509t |