| SpectraBase Spectrum ID |
AXsROUPBkGD |
| Name |
Mitraphylline |
| CAS Registry Number |
509-80-8 |
| Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
368.173607257 u |
| Formula |
C21H24N2O4 |
| GC Column |
HP-5ms (30 m × 0.25 mm ID x 0.25 μm film thickness) |
| InChI |
InChI=1S/C21H24N2O4/c1-12-14-10-23-8-7-21(16-5-3-4-6-17(16)22-20(21)25)18(23)9-13(14)15(11-27-12)19(24)26-2/h3-6,11-14,18H,7-10H2,1-2H3,(H,22,25)/t12-,13-,14+,18-,21+/m0/s1 |
| InChIKey |
JMIAZDVHNCCPDM-DAFCLMLCSA-N |
| Molecular Weight |
368.433 g/mol |
| Nominal Mass |
368 u |
| Number of Peaks |
302 |
| SMILES |
N1c2c([C@@]3(C1=O)[C@]1(N(C[C@]4([C@](C1)(C(=CO[C@]4(C)[H])C(OC)=O)[H])[H])CC3)[H])cccc2 |
| SPLASH |
splash10-00xr-5963000000-d082c7abd7fb2356985c |
| Source |
authentic prep from WUM, extracted from Uncaria tomentosa |
| Source of Spectrum |
Biologically and Environmentally Important Organic Compounds: GCMS Library |
| Wiley ID |
VI001711 |
