| SpectraBase Compound ID | 9MyiaYgB1Ow |
|---|---|
| InChI | InChI=1S/C48H77N7O15/c1-5-26(2)14-12-10-8-6-7-9-11-13-15-37(62)49-32-22-36(61)44(66)53-46(68)40-41(63)27(3)23-55(40)47(69)33(25-56)50-45(67)39(35(60)20-29-16-18-30(58)19-17-29)52-43(65)34-21-31(59)24-54(34)48(70)38(28(4)57)51-42(32)64/h16-19,26-28,31-36,38-41,44,56-61,63,66H,5-15,20-25H2,1-4H3,(H,49,62)(H,50,67)(H,51,64)(H,52,65)(H,53,68) |
| InChIKey | GWBOEEVOSDBARW-UHFFFAOYSA-N |
| Mol Weight | 992.2 g/mol |
| Molecular Formula | C48H77N7O15 |
| Exact Mass | 991.547765 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JYsHjYbdzMu |
|---|---|
| Name | DEOXY-MULUNDOCANDIN |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C48H77N7O15 |
| InChI | InChI=1S/C48H77N7O15/c1-5-26(2)14-12-10-8-6-7-9-11-13-15-37(62)49-32-22-36(61)44(66)53-46(68)40-41(63)27(3)23-55(40)47(69)33(25-56)50-45(67)39(35(60)20-29-16-18-30(58)19-17-29)52-43(65)34-21-31(59)24-54(34)48(70)38(28(4)57)51-42(32)64/h16-19,26-28,31-36,38-41,44,56-61,63,66H,5-15,20-25H2,1-4H3,(H,49,62)(H,50,67)(H,51,64)(H,52,65)(H,53,68) |
| InChIKey | GWBOEEVOSDBARW-UHFFFAOYSA-N |
| Literature Reference Author | T.MUKHOPADHYAY,K.ROY,R.G.BHAT,S.N.SAWANT,J.BLUMBACH,B.N.GANG ULI,H.W.FEHLHABER,H. |
| Literature Reference Citation | J.ANTIBIOTICS,45,618(1992) |
| Literature Reference DOI | 10.7164/antibiotics.45.618 |
| Molecular Weight | 992.177 g/mol |
| Sample ID | 45859 |
| Solvent | DMSO-D6 |