| SpectraBase Spectrum ID |
Est3kDnlnCQ |
| Name |
Methyl 5,8,11-triisobutyl-3,6,9-trioxo-1-phenyl-2-oxa-4,7,10-triazadodecan-12-oate, [13C]-labelled |
| Alternate Name(s) |
l-Leucine, N-[N-[N-[(phenylmethoxy)carbonyl]-l-leucyl]-l-leucyl]-, methyl ester, [¹³C]-labelled |
| CAS Registry Number |
66013-79-4 |
| Comments |
Original formula: C26[13C]H43N3O6 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H43N3O6 |
| InChI |
InChI=1S/C27H43N3O6/c1-17(2)13-21(24(31)29-23(15-19(5)6)26(33)35-7)28-25(32)22(14-18(3)4)30-27(34)36-16-20-11-9-8-10-12-20/h8-12,17-19,21-23H,13-16H2,1-7H3,(H,28,32)(H,29,31)(H,30,34)/i25+1 |
| InChIKey |
IUFKCGIZJPZEMT-XFDDJFSZSA-N |
| Molecular Weight |
506.648 g/mol |
| SMILES |
N([13C](C(NC(=O)OCc1ccccc1)CC(C)C)=O)C(C(NC(C(=O)OC)CC(C)C)=O)CC(C)C |
| SPLASH |
splash10-000f-9210000000-35574bac7a15d02c0088 |
| Wiley ID |
1485447 |
![Methyl 5,8,11-triisobutyl-3,6,9-trioxo-1-phenyl-2-oxa-4,7,10-triazadodecan-12-oate, [13C]-labelled](/api/spectrum/Est3kDnlnCQ/structure.png?h=300&w=458 "Methyl 5,8,11-triisobutyl-3,6,9-trioxo-1-phenyl-2-oxa-4,7,10-triazadodecan-12-oate, [13C]-labelled")
