| SpectraBase Compound ID | Bwaoml04zP2 |
|---|---|
| InChI | InChI=1S/C36H58N6O7/c1-11-22(10)30-36(49)38-26(17-23-12-14-24(43)15-13-23)32(45)39-28(20(6)7)34(47)41-29(21(8)9)35(48)40-27(19(4)5)33(46)37-25(16-18(2)3)31(44)42-30/h12-15,18-22,25-30,43H,11,16-17H2,1-10H3,(H,37,46)(H,38,49)(H,39,45)(H,40,48)(H,41,47)(H,42,44)/t22-,25+,26-,27+,28+,29-,30-/m0/s1 |
| InChIKey | IWXQKCGWVSNLIQ-NQPQJUOKSA-N |
| Mol Weight | 686.9 g/mol |
| Molecular Formula | C36H58N6O7 |
| Exact Mass | 686.436698 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BSXtwc9dMI1 |
|---|---|
| Name | NOCARDIAMIDE_A;CYCLO-(L-TYR-L-ILE-D-LEU-D-VAL-L-VAL-D-VAL) |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H58N6O7 |
| InChI | InChI=1S/C36H58N6O7/c1-11-22(10)30-36(49)38-26(17-23-12-14-24(43)15-13-23)32(45)39-28(20(6)7)34(47)41-29(21(8)9)35(48)40-27(19(4)5)33(46)37-25(16-18(2)3)31(44)42-30/h12-15,18-22,25-30,43H,11,16-17H2,1-10H3,(H,37,46)(H,38,49)(H,39,45)(H,40,48)(H,41,47)(H,42,44)/t22-,25+,26-,27+,28+,29-,30-/m0/s1 |
| InChIKey | IWXQKCGWVSNLIQ-NQPQJUOKSA-N |
| Literature Reference Author | Z.C.WU,S.LI,S.J.NAM,Z.LIU,C.ZHANG |
| Literature Reference Citation | J.NAT.PROD.,76,694(2013) |
| Literature Reference DOI | 10.1021/np400009a |
| Molecular Weight | 686.893 g/mol |
| Sample ID | 42422 |
| Solvent | DMSO-D6 |