| SpectraBase Compound ID | DgBvRJsnEc9 |
|---|---|
| InChI | InChI=1S/C15H18N4O5/c1-5-9(16)12(21)8-6(4-24-14(17)22)15(23-2)13-7(18-13)3-19(15)10(8)11(5)20/h6-7,13,18H,3-4,16H2,1-2H3,(H2,17,22) |
| InChIKey | NWIBSHFKIJFRCO-UHFFFAOYSA-N |
| Mol Weight | 334.33 g/mol |
| Molecular Formula | C15H18N4O5 |
| Exact Mass | 334.12772 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | E2zgYXdWuri |
|---|---|
| Name | Mitomycin |
| Alternate Name(s) | (6-Amino-8a-methoxy-5-methyl-4,7-dioxo-1,1a,2,4,7,8,8a,8b-octahydroazireno[2',3':3,4]pyrrolo[1,2-a]indol-8-yl)methyl carbamate, (1aS,8S,8aR,8bS)- Azirino[2',3':3,4]pyrrolo[1,2-a]indole-4,7-dione, 6-amino-8-[[(aminocarbonyl)oxy]methyl]-1,1a,2,8,8a,8b-hexahydro-8a-methoxy-5-methyl-, [1aS-(1a.alpha.,8.beta.,8a.alpha.,8b.alpha.)]- Mitomycin C Azirino[2',3':3,4]pyrrolo[1,2-a]indole-4,7-dione, 6-amino-1,1a,2,8,8a,8b-hexahydro-8-(hydroxymethyl)-8a-methoxy-5-methyl-, carbamate (ester) Ametycine 7-Amino-9.alpha.-methoxymitosane Azirino(2',3':3,4)pyrrolo(1,2-a)indole-4,7-dione, 6-amino-1,1a,2,8,8a,8b-hexahydro-8-(hydroxymethyl)-8a-methoxy-5-methyl-, carbamate Mitomycyna C 6-Amino-1,1a,2,8,8a,8b-hexahydro-8-(hydroxymethyl)-8a-methoxy-5-methylazirino[2',3':3,4]pyrrolo[1,2-a]indole-4,7-dione carbamate (ester) (1aS,8S,8aR,8bS)-6-amino-1,1a,2,8,8a,8b-hexahydro-8-(hydroxymethyl)-8a-methoxy-5-methylazirino[2',3':3,4]pyrrolo[1,2-a]indole-4,7-dionecarbamate (ester) |
| CAS Registry Number | 50-07-7 |
| Comments | Structure changed after expert review |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C15H18N4O5 |
| InChI | InChI=1S/C15H18N4O5/c1-5-9(16)12(21)8-6(4-24-14(17)22)15(23-2)13-7(18-13)3-19(15)10(8)11(5)20/h6-7,13,18H,3-4,16H2,1-2H3,(H2,17,22) |
| InChIKey | NWIBSHFKIJFRCO-UHFFFAOYSA-N |
| Molecular Weight | 334.332 g/mol |
| SMILES | NC(OCC1C=2C(C(=C(C(C2N2C1(C1C(C2)N1)OC)=O)C)N)=O)=O |
| SPLASH | splash10-0006-4293000000-dc0be675fedb61d888ab |
| Source of Spectrum | F-26-2588-3 |
| Wiley ID | 49862 |