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CHEBI:177572 - Nisterime acetate
| Formula | C27H35ClN2O5 |
| Net Charge | 0 |
| Average Mass | 503.039 |
| Monoisotopic Mass | 502.22345 |
| SMILES | [H][C@@]12CC[C@]3([H])[C@]([H])(CC[C@]4(C)[C@@H](OC(C)=O)CC[C@@]34[H])[C@@]1(C)C[C@@H](Cl)/C(=N\Oc1ccc([N+](=O)[O-])cc1)C2 |
| InChI | InChI=1S/C27H35ClN2O5/c1-16(31)34-25-11-10-21-20-9-4-17-14-24(29-35-19-7-5-18(6-8-19)30(32)33)23(28)15-27(17,3)22(20)12-13-26(21,25)2/h5-8,17,20-23,25H,4,9-15H2,1-3H3/b29-24-/t17-,20-,21-,22-,23+,25-,26-,27-/m0/s1 |
| InChIKey | NNFGKFKPLQYECP-BYXNGVTISA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Sus scrofa (ncbitaxon:9823) | Sausage (ENVO:00002166) | MetaboLights (MTBLS2871) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Nisterime acetate (CHEBI:177572) is a steroid ester (CHEBI:47880) |
| IUPAC Name |
|---|
| [(2R,3Z,5S,8R,9S,10S,13S,14S,17S)-2-chloro-10,13-dimethyl-3-(4-nitrophenoxy)imino-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl] acetate |