| SpectraBase Compound ID | 3gnSchm5Gq3 |
|---|---|
| InChI | InChI=1S/C60H88N2O20/c1-12-60(70)26-41(79-46-24-34(61(8)9)57(31(6)75-46)80-44-22-18-39(29(4)73-44)77-42-20-16-36(63)27(2)71-42)49-52(56(69)50-51(55(49)68)54(67)48-33(53(50)66)14-13-15-38(48)65)59(60)82-47-25-35(62(10)11)58(32(7)76-47)81-45-23-19-40(30(5)74-45)78-43-21-17-37(64)28(3)72-43/h13-15,27-32,34-37,39-47,57-59,63-65,68-70H,12,16-26H2,1-11H3/t27-,28-,29-,30+,31+,32-,34+,35-,36-,37-,39-,40+,41-,42-,43-,44-,45+,46+,47-,57-,58+,59+,60-/m0/s1 |
| InChIKey | JCVKGZNZMVGUIP-OFSLNPFVSA-N |
| Mol Weight | 1157.4 g/mol |
| Molecular Formula | C60H88N2O20 |
| Exact Mass | 1156.593043 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9C9HWGhjlqJ |
|---|---|
| Name | A-262-1;A447-C |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C60H88N2O20 |
| InChI | InChI=1S/C60H88N2O20/c1-12-60(70)26-41(79-46-24-34(61(8)9)57(31(6)75-46)80-44-22-18-39(29(4)73-44)77-42-20-16-36(63)27(2)71-42)49-52(56(69)50-51(55(49)68)54(67)48-33(53(50)66)14-13-15-38(48)65)59(60)82-47-25-35(62(10)11)58(32(7)76-47)81-45-23-19-40(30(5)74-45)78-43-21-17-37(64)28(3)72-43/h13-15,27-32,34-37,39-47,57-59,63-65,68-70H,12,16-26H2,1-11H3/t27-,28-,29-,30+,31+,32-,34+,35-,36-,37-,39-,40+,41-,42-,43-,44-,45+,46+,47-,57-,58+,59+,60-/m0/s1 |
| InChIKey | JCVKGZNZMVGUIP-OFSLNPFVSA-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 | 1157.360 g/mol |
| Sample ID | 66551 |
| Solvent | CDCl3 |