| SpectraBase Compound ID | HOWtdIdBDNm |
|---|---|
| InChI | InChI=1S/C17H25N5O7/c1-8(23)12(16(28)29)22-15(27)10(5-3-7-20-17(18)19)21-14(26)9-4-2-6-11(24)13(9)25/h2,4,6,8,10,12,23-25H,3,5,7H2,1H3,(H,21,26)(H,22,27)(H,28,29)(H4,18,19,20)/t8-,10+,12+/m1/s1 |
| InChIKey | RYFDAFYFFUVLNW-QRTLGDNMSA-N |
| Mol Weight | 411.42 g/mol |
| Molecular Formula | C17H25N5O7 |
| Exact Mass | 411.175398 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | PwumUQFgcz |
|---|---|
| Name | BENARTHIN;L-N-(2,3-DIHYDROXYBENZOYL)-ARGINYL-L-THREONINE |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C17H25N5O7 |
| InChI | InChI=1S/C17H25N5O7/c1-8(23)12(16(28)29)22-15(27)10(5-3-7-20-17(18)19)21-14(26)9-4-2-6-11(24)13(9)25/h2,4,6,8,10,12,23-25H,3,5,7H2,1H3,(H,21,26)(H,22,27)(H,28,29)(H4,18,19,20)/t8-,10+,12+/m1/s1 |
| InChIKey | RYFDAFYFFUVLNW-QRTLGDNMSA-N |
| Literature Reference Author | M.HATSU,H.NAGANAWA,T.AOYAGI,T.TAKEUCHI |
| Literature Reference Citation | J.ANTIBIOTICS,45,1084(1992) |
| Literature Reference DOI | 10.7164/antibiotics.45.1084 |
| Molecular Weight | 411.415 g/mol |
| Sample ID | 40583 |
| Solvent | DMSO-D6 |