| SpectraBase Compound ID | 1WIlgJVUwUp |
|---|---|
| InChI | InChI=1S/C31H40N2O7/c1-5-6-11-20(2)16-21(3)17-22(4)30(39)32-23-19-31(40,27(37)18-26(23)36)15-10-8-7-9-12-28(38)33-29-24(34)13-14-25(29)35/h7-10,12,15-17,19-20,27,34,37,40H,5-6,11,13-14,18H2,1-4H3,(H,32,39)(H,33,38)/b8-7+,12-9+,15-10+,21-16+,22-17+/t20?,27-,31+/m1/s1 |
| InChIKey | VUBKFRUSHLYSFD-JLUMCTDQSA-N |
| Mol Weight | 552.7 g/mol |
| Molecular Formula | C31H40N2O7 |
| Exact Mass | 552.283552 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6pAdjAcypDv |
|---|---|
| Name | MANUMYCIN-D |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H40N2O7 |
| InChI | InChI=1S/C31H40N2O7/c1-5-6-11-20(2)16-21(3)17-22(4)30(39)32-23-19-31(40,27(37)18-26(23)36)15-10-8-7-9-12-28(38)33-29-24(34)13-14-25(29)35/h7-10,12,15-17,19-20,27,34,37,40H,5-6,11,13-14,18H2,1-4H3,(H,32,39)(H,33,38)/b8-7+,12-9+,15-10+,21-16+,22-17+/t20?,27-,31+/m1/s1 |
| InChIKey | VUBKFRUSHLYSFD-JLUMCTDQSA-N |
| Literature Reference Author | I.SATTLER,C.GROENE,A.ZEECK |
| Literature Reference Citation | J.ORG.CHEM.,58,6583(1993) |
| Literature Reference DOI | 10.1021/jo00076a015 |
| Molecular Weight | 552.668 g/mol |
| Solvent | CDCl3:CD3OD=9:1 |
| Source File Reference | UWCS19551 |