[English] 日本語
Yorodumi- ChemComp-OAU: 3-[(1~{S},2~{R},3~{S},6~{S})-3-ethenyl-2-isocyano-3-methyl-6-prop... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: OAU |
---|---|
Name | Name: Synonyms: 12-epi-hapalindole C isoniltrile; 3-[(1R,2S,3R,6R)-3-ethenyl-2-isocyano-3-methyl-6-prop-1-en-2-ylcyclohexyl]-1H-indole |
-Chemical information
Composition | Formula: C21H24N2 / Number of atoms: 47 / Formula weight: 304.429 / Formal charge: 0 | ||||
---|---|---|---|---|---|
Others | Type: non-polymer / PDB classification: HETAIN / Three letter code: OAU / Ideal coordinates details: Corina / Model coordinates PDB-ID: 8AUT | ||||
History |
| ||||
External links | UniChem / ChemSpider / Brenda / NMRShiftDB / Nikkaji / PubChem / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
---|
-Details
-SMILES
CACTVS 3.385 | OpenEye OEToolkits 3.1.0.0 | |
---|
-SMILES CANONICAL
CACTVS 3.385 | OpenEye OEToolkits 3.1.0.0 | |
---|
-InChI
InChI 1.06 |
---|
-InChIKey
InChI 1.06 |
---|
-PDB entries
Showing all 1 items
PDB-8aut:
WelO5* L221A bound to Zn(II), Cl, 2-oxoglutarate, and 12-epi-hapalindole C