| SpectraBase Compound ID | HzZuWA5KjZI |
|---|---|
| InChI | InChI=1S/C29H41N9O10/c1-15-23(41)35-17(10-7-11-32-28(30)37-29(48)31-2)25(43)38(3)20(12-16-8-5-4-6-9-16)24(42)36-19(27(46)47)14-22(40)34-18(26(44)45)13-21(39)33-15/h4-6,8-9,15,17-20H,7,10-14H2,1-3H3,(H,33,39)(H,34,40)(H,35,41)(H,36,42)(H,44,45)(H,46,47)(H4,30,31,32,37,48) |
| InChIKey | UHBHXSDKGLPPGO-UHFFFAOYSA-N |
| Mol Weight | 675.7 g/mol |
| Molecular Formula | C29H41N9O10 |
| Exact Mass | 675.297639 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BzbbkCK5N7C |
|---|---|
| Name | ARGIFIN;CYCLO-(N-(OMEGA)-(N-METHYLCARBAMOYL)-L-ARGINYL-N-METHYL-L-PHENYLALANYL-BETA-L-ASPARTYL-D-ALANYL |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H41N9O10 |
| InChI | InChI=1S/C29H41N9O10/c1-15-23(41)35-17(10-7-11-32-28(30)37-29(48)31-2)25(43)38(3)20(12-16-8-5-4-6-9-16)24(42)36-19(27(46)47)14-22(40)34-18(26(44)45)13-21(39)33-15/h4-6,8-9,15,17-20H,7,10-14H2,1-3H3,(H,33,39)(H,34,40)(H,35,41)(H,36,42)(H,44,45)(H,46,47)(H4,30,31,32,37,48) |
| InChIKey | UHBHXSDKGLPPGO-UHFFFAOYSA-N |
| Literature Reference Author | N.ARAI,K.SHIOMI,Y.IWAI,S.OMURA |
| Literature Reference Citation | J.ANTIBIOTICS,53,609(2000) |
| Literature Reference DOI | 10.7164/antibiotics.53.609 |
| Molecular Weight | 675.699 g/mol |
| Solvent | D2O:TFA=249:1;PH=4 |
| Source File Reference | UWRU8147 |