| SpectraBase Compound ID | CUqnAFLy28z |
|---|---|
| InChI | InChI=1S/C47H62N8O16/c1-24(10-6-4-5-7-11-25-14-16-27(71-3)17-15-25)38(61)39(62)37-40(63)44(66)53-42-41(64)45(67)54-47(42,70)20-35(60)55(2)23-34(59)50-31(19-29-28-12-8-9-13-30(28)51-36(29)46(68)69)43(65)49-22-33(58)48-21-26(56)18-32(57)52-37/h7-9,11-17,24,26,31,37-42,51,56,61-64,70H,4-6,10,18-23H2,1-3H3,(H,48,58)(H,49,65)(H,50,59)(H,52,57)(H,53,66)(H,54,67)(H,68,69)/b11-7+/t24-,26?,31+,37+,38+,39-,40-,41+,42-,47-/m1/s1 |
| InChIKey | SUTLNZKJLZEWSJ-SGYTXLQKSA-N |
| Mol Weight | 995.1 g/mol |
| Molecular Formula | C47H62N8O16 |
| Exact Mass | 994.428378 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IGGP87ruAfx |
|---|---|
| Name | MICROSCLERODERMIN-A |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C47H62N8O16 |
| InChI | InChI=1S/C47H62N8O16/c1-24(10-6-4-5-7-11-25-14-16-27(71-3)17-15-25)38(61)39(62)37-40(63)44(66)53-42-41(64)45(67)54-47(42,70)20-35(60)55(2)23-34(59)50-31(19-29-28-12-8-9-13-30(28)51-36(29)46(68)69)43(65)49-22-33(58)48-21-26(56)18-32(57)52-37/h7-9,11-17,24,26,31,37-42,51,56,61-64,70H,4-6,10,18-23H2,1-3H3,(H,48,58)(H,49,65)(H,50,59)(H,52,57)(H,53,66)(H,54,67)(H,68,69)/b11-7+/t24-,26?,31+,37+,38+,39-,40-,41+,42-,47-/m1/s1 |
| InChIKey | SUTLNZKJLZEWSJ-SGYTXLQKSA-N |
| Literature Reference Author | C.A.BEWLEY,C.DEBITUS,D.J.FAULKNER |
| Literature Reference Citation | J.AM.CHEM.SOC.,116,7631(1994) |
| Literature Reference DOI | 10.1021/ja00096a020 |
| Molecular Weight | 995.053 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWSI70 |