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 |
SpectraBase Spectrum ID | 49Gelif1iuZ |
---|---|
Name | F-16438_E |
Compound Number | 3 |
Copyright | Copyright © 2016-2025 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 |