| SpectraBase Compound ID | AkRdQpH1i1X |
|---|---|
| InChI | InChI=1S/C60H88N2O22/c1-12-60(72)24-39(79-42-20-32(61(8)9)55(27(4)75-42)82-44-22-37(66)57(29(6)77-44)80-40-18-16-34(63)25(2)73-40)47-50(54(71)48-49(53(47)70)52(69)46-31(51(48)68)14-13-15-36(46)65)59(60)84-43-21-33(62(10)11)56(28(5)76-43)83-45-23-38(67)58(30(7)78-45)81-41-19-17-35(64)26(3)74-41/h13-15,25-30,32-35,37-45,55-59,63-67,70-72H,12,16-24H2,1-11H3/t25-,26-,27-,28+,29-,30+,32-,33+,34-,35-,37-,38+,39+,40-,41-,42-,43+,44-,45+,55+,56-,57+,58-,59-,60+/m1/s1 |
| InChIKey | DKWBRHNUUTWKAG-VXOUUMQTSA-N |
| Mol Weight | 1189.4 g/mol |
| Molecular Formula | C60H88N2O22 |
| Exact Mass | 1188.582872 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7dyW436aRie |
|---|---|
| Name | A-262-3;COSMOMYCIN-D |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C60H88N2O22 |
| InChI | InChI=1S/C60H88N2O22/c1-12-60(72)24-39(79-42-20-32(61(8)9)55(27(4)75-42)82-44-22-37(66)57(29(6)77-44)80-40-18-16-34(63)25(2)73-40)47-50(54(71)48-49(53(47)70)52(69)46-31(51(48)68)14-13-15-36(46)65)59(60)84-43-21-33(62(10)11)56(28(5)76-43)83-45-23-38(67)58(30(7)78-45)81-41-19-17-35(64)26(3)74-41/h13-15,25-30,32-35,37-45,55-59,63-67,70-72H,12,16-24H2,1-11H3/t25-,26-,27-,28+,29-,30+,32-,33+,34-,35-,37-,38+,39+,40-,41-,42-,43+,44-,45+,55+,56-,57+,58-,59-,60+/m1/s1 |
| InChIKey | DKWBRHNUUTWKAG-VXOUUMQTSA-N |
| Literature Reference Author | O.JOHDO,T.ISHIKURA,A.YOSHIMOTO,T.TAKEUCHI |
| Literature Reference Citation | J.ANTIBIOTICS,44,1110(1991) |
| Literature Reference DOI | 10.7164/antibiotics.44.1110 |
| Molecular Weight | 1189.359 g/mol |
| Sample ID | 66553 |
| Solvent | CDCl3 |