| SpectraBase Compound ID | K6lc69sLE0Q |
|---|---|
| InChI | InChI=1S/C44H62N2O12/c1-10-12-14-22-32-43(6,7)39(51)40(52)44(55,58-32)29(11-2)41(53)45-24-18-17-20-27(4)37(56-9)28(5)38-36(50)35(49)31(57-38)21-16-13-15-19-26(3)34(48)33-30(47)23-25-46(8)42(33)54/h10,12-23,25,28-29,31-32,35-40,47,49-52,55H,11,24H2,1-9H3,(H,45,53)/b12-10-,15-13+,18-17+,21-16+,22-14+,26-19+,27-20+/t28?,29?,31?,32-,35?,36?,37?,38?,39-,40+,44+/m1/s1 |
| InChIKey | NTAHMPNXQOYXSX-AEDKJOOWSA-N |
| Mol Weight | 811.0 g/mol |
| Molecular Formula | C44H62N2O12 |
| Exact Mass | 810.430275 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AkRtlyrdsPM |
|---|---|
| Name | AURODOX |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C44H62N2O12 |
| InChI | InChI=1S/C44H62N2O12/c1-10-12-14-22-32-43(6,7)39(51)40(52)44(55,58-32)29(11-2)41(53)45-24-18-17-20-27(4)37(56-9)28(5)38-36(50)35(49)31(57-38)21-16-13-15-19-26(3)34(48)33-30(47)23-25-46(8)42(33)54/h10,12-23,25,28-29,31-32,35-40,47,49-52,55H,11,24H2,1-9H3,(H,45,53)/b12-10-,15-13+,18-17+,21-16+,22-14+,26-19+,27-20+/t28?,29?,31?,32-,35?,36?,37?,38?,39-,40+,44+/m1/s1 |
| InChIKey | NTAHMPNXQOYXSX-AEDKJOOWSA-N |
| Literature Reference Author | R.S.DEWEY,O.D.HENSENS,A.W.DOUGLAS,G.ALBERS-SCHOENBERG |
| Literature Reference Citation | J.ANTIBIOTICS,44,838(1991) |
| Literature Reference DOI | 10.7164/antibiotics.44.838 |
| Molecular Weight | 810.982 g/mol |
| Sample ID | 66538 |
| Solvent | ACETONE-D6:CD3COOD |