| SpectraBase Compound ID | ElTeDHGvUqf |
|---|---|
| InChI | InChI=1S/C26H49N5O4/c1-5-18(3)12-9-7-8-10-13-20-16-22(32)28-17-23(33)30-21(14-11-15-27)25(34)31-24(19(4)6-2)26(35)29-20/h18-21,24H,5-17,27H2,1-4H3,(H,28,32)(H,29,35)(H,30,33)(H,31,34)/t18?,19?,20?,21-,24-/m0/s1 |
| InChIKey | ITBKUPNSNYDPST-YEUCXLETSA-N |
| Mol Weight | 495.7 g/mol |
| Molecular Formula | C26H49N5O4 |
| Exact Mass | 495.378455 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ALR1yunU5pN |
|---|---|
| Name | CYCLO-(-GLY-L-ORN-L-ILE-3-AMINO-10-METHYL-DODECANOYL-);RHODOPEPTIN-C2 |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C26H49N5O4 |
| InChI | InChI=1S/C26H49N5O4/c1-5-18(3)12-9-7-8-10-13-20-16-22(32)28-17-23(33)30-21(14-11-15-27)25(34)31-24(19(4)6-2)26(35)29-20/h18-21,24H,5-17,27H2,1-4H3,(H,28,32)(H,29,35)(H,30,33)(H,31,34)/t18?,19?,20?,21-,24-/m0/s1 |
| InChIKey | ITBKUPNSNYDPST-YEUCXLETSA-N |
| Literature Reference Author | H.CHIBA,H.AGEMATU,K.DOBASHI,T.YOSHIOKA |
| Literature Reference Citation | J.ANTIBIOTICS,52,700(1999) |
| Literature Reference DOI | 10.7164/antibiotics.52.700 |
| Molecular Weight | 495.706 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWRU1012 |