| SpectraBase Spectrum ID |
70Vk9XF7rXO |
| Name |
Methyl 13-[N-(2'-hydroxy-',1'-dimethylethyl)carbamoyl]-12-methoxypodocarpa-8,11,13-triene-19-oate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
417.251523226 u |
| Formula |
C24H35NO5 |
| InChI |
InChI=1S/C24H35NO5/c1-22(2,14-26)25-20(27)16-12-15-8-9-19-23(3,17(15)13-18(16)29-5)10-7-11-24(19,4)21(28)30-6/h12-13,19,26H,7-11,14H2,1-6H3,(H,25,27)/t19?,23-,24+/m1/s1 |
| InChIKey |
OUQDTFVOJGYSIV-XRVPCZGUSA-N |
| Molecular Weight |
417.546 g/mol |
| SMILES |
C1(C(NC(CO)(C)C)=O)=CC=2CCC3[C@@](C2C=C1OC)(CCC[C@@]3(C(=O)OC)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.868438 |
![Methyl 13-[N-(2'-hydroxy-',1'-dimethylethyl)carbamoyl]-12-methoxypodocarpa-8,11,13-triene-19-oate](/api/spectrum/70Vk9XF7rXO/structure.png?h=300&w=458 "Methyl 13-[N-(2'-hydroxy-',1'-dimethylethyl)carbamoyl]-12-methoxypodocarpa-8,11,13-triene-19-oate")
