| SpectraBase Compound ID | 5DzFk2JAf5E |
|---|---|
| InChI | InChI=1S/C23H37NO6/c1-4-24-10-20(11-29-2)6-5-16(25)23-15(20)7-13(19(23)24)21(27)9-14(30-3)12-8-22(23,28)18(21)17(12)26/h12-19,25-28H,4-11H2,1-3H3/t12-,13+,14+,15-,16+,17+,18?,19?,20+,21+,22+,23+/m1/s1 |
| InChIKey | MRRCEBWYLXRYLK-DVAUNJNISA-N |
| Mol Weight | 423.6 g/mol |
| Molecular Formula | C23H37NO6 |
| Exact Mass | 423.262088 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 92Nq3a3Pq0N |
|---|---|
| Name | 10-Hydroxyisotalatizidine |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C23H37NO6 |
| InChI | InChI=1S/C23H37NO6/c1-4-24-10-20(11-29-2)6-5-16(25)23-15(20)7-13(19(23)24)21(27)9-14(30-3)12-8-22(23,28)18(21)17(12)26/h12-19,25-28H,4-11H2,1-3H3/t12-,13+,14+,15-,16+,17+,18?,19?,20+,21+,22+,23+/m1/s1 |
| InChIKey | MRRCEBWYLXRYLK-DVAUNJNISA-N |
| Molecular Weight | 423.550 g/mol |
| SMILES | O[C@@]1(C2[C@@]3([C@]45[C@](CC[C@]6(CN(C5[C@@]([C@]2(C[C@@]([C@]1(C3)[H])(OC)[H])O)(C[C@@]46[H])[H])CC)COC)(O)[H])O)[H] |
| SPLASH | splash10-0a4i-0000900000-ca96dee8db0a95072f2d |
| Source of Spectrum | E1-40-2930-5 |
| Wiley ID | 1551721 |