| SpectraBase Compound ID | LLhN2L4KQNb |
|---|---|
| InChI | InChI=1S/C42H66O18/c1-25(18-15-13-11-9-7-5-4-6-8-10-12-14-16-20-29(47)22-28-19-17-21-30(48)33(28)40(53)54)56-41(55)38(57-26(2)45)36(51)34(49)31(23-43)59-42-39(58-27(3)46)37(52)35(50)32(24-44)60-42/h17,19,21,25,31-32,34-39,42-44,48-52H,4-16,18,20,22-24H2,1-3H3,(H,53,54)/t25?,31-,32-,34-,35-,36+,37+,38+,39+,42?/m1/s1 |
| InChIKey | MBAUUCGANHACJM-LQALXXDBSA-N |
| Mol Weight | 859.0 g/mol |
| Molecular Formula | C42H66O18 |
| Exact Mass | 858.424915 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 49Gelif1iuZ |
|---|---|
| Name | F-16438_E |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C42H66O18 |
| InChI | InChI=1S/C42H66O18/c1-25(18-15-13-11-9-7-5-4-6-8-10-12-14-16-20-29(47)22-28-19-17-21-30(48)33(28)40(53)54)56-41(55)38(57-26(2)45)36(51)34(49)31(23-43)59-42-39(58-27(3)46)37(52)35(50)32(24-44)60-42/h17,19,21,25,31-32,34-39,42-44,48-52H,4-16,18,20,22-24H2,1-3H3,(H,53,54)/t25?,31-,32-,34-,35-,36+,37+,38+,39+,42?/m1/s1 |
| InChIKey | MBAUUCGANHACJM-LQALXXDBSA-N |
| Literature Reference Author | Y.HIROTA-TAKAHATA,H.HARADA,I.TANAKA,T.NAKATA,M.NAKAJIMA,M.TA KAHASHI |
| Literature Reference Citation | J.ANTIBIOTICS,59,777(2006) |
| Literature Reference DOI | 10.1038/ja.2006.102 |
| Molecular Weight | 858.975 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMB144 |