| SpectraBase Spectrum ID |
2zWFZJcJT9U |
| Name |
(2R)-2-[[(2S)-2-[2-[(1R,2R)-2-acetamidocyclohexyl]oxyethanoylamino]propanoyl]amino]pentanedioic acid |
| Alternate Name(s) |
(2R)-2-[[(2S)-2-[[2-[(1R,2R)-2-acetamidocyclohexoxy]acetyl]amino]propanoyl]amino]glutaric acid
(2R)-2-[[(2S)-2-[[2-[(1R,2R)-2-acetamidocyclohexoxy]acetyl]amino]propanoyl]amino]pentanedioic acid
(2R)-2-[[(2S)-2-[[2-[(1R,2R)-2-acetamidocyclohexyl]oxy-1-oxoethyl]amino]-1-oxopropyl]amino]pentanedioic acid
(2R)-2-[[(2S)-2-[[2-[(1R,2R)-2-acetamidocyclohexyl]oxyacetyl]amino]propanoyl]amino]pentanedioic acid |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H29N3O8 |
| InChI |
InChI=1S/C18H29N3O8/c1-10(17(26)21-13(18(27)28)7-8-16(24)25)19-15(23)9-29-14-6-4-3-5-12(14)20-11(2)22/h10,12-14H,3-9H2,1-2H3,(H,19,23)(H,20,22)(H,21,26)(H,24,25)(H,27,28)/t10-,12+,13+,14+/m0/s1 |
| InChIKey |
DMEDSRFSRBDYQJ-IGHBBLSQSA-N |
| Molecular Weight |
415.443 g/mol |
| SMILES |
N(C([C@@](NC(CO[C@]1([C@](NC(=O)C)(CCCC1)[H])[H])=O)(C)[H])=O)[C@](CCC(=O)O)(C(=O)O)[H] |
| SPLASH |
splash10-001i-9000000000-16588573de95ee6c44ac |
| Source of Spectrum |
F2-41-535-9 |
| Wiley ID |
1599460 |
![(2R)-2-[[(2S)-2-[2-[(1R,2R)-2-acetamidocyclohexyl]oxyethanoylamino]propanoyl]amino]pentanedioic acid](/api/spectrum/2zWFZJcJT9U/structure.png?h=300&w=458 "(2R)-2-[[(2S)-2-[2-[(1R,2R)-2-acetamidocyclohexyl]oxyethanoylamino]propanoyl]amino]pentanedioic acid")
