| NACRES | NA.24 |
|---|---|
| PubChem Substance ID | 329831147 |
| UNSPSC Code | 41116107 |
| MDL number | MFCD00078588 |
| InChI | 1S/C20H25N3O2.C4H4O4/c1-3-14(11-24)22-20(25)13-7-16-15-5-4-6-17-19(15)12(9-21-17)8-18(16)23(2)10-13;5-3(6)1-2-4(7)8/h4-7,9,13-14,18,21,24H,3,8,10-11H2,1-2H3,(H,22,25);1-2H,(H,5,6)(H,7,8)/b;2-1-/t13-,14+,18-;/m1./s1 |
| SMILES string | [H]\C(=C(/[H])C(O)=O)C(O)=O.[H][C@@]12Cc3c[nH]c4cccc(C1=C[C@H](CN2C)C(=O)N[C@@H](CC)CO)c34 |
| InChI key | NOFOWWRHEPHDCY-DAUURJMHSA-N |
| grade | pharmaceutical primary standard |
| API family | methylergometrine |
| manufacturer/tradename | EDQM |
| application(s) | pharmaceutical (small molecule) |
| format | neat |
| storage temp. | 2-8°C |
| Gene Information | human ... DRD1(1812), HTR2B(3357) |
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