| SpectraBase Compound ID | 6AN38WEq5LN |
|---|---|
| InChI | InChI=1S/C50H50O10/c1-24(2)9-12-27-17-32(39(53)21-37(27)51)49-42(34-20-40(54)48-30(46(34)59-49)15-16-50(7,8)60-48)44(56)35-19-31-36-23-57-41-22-38(52)28(13-10-25(3)4)18-33(41)47(36)58-45(31)29(43(35)55)14-11-26(5)6/h9-11,15-22,36,47,51-55H,12-14,23H2,1-8H3/t36-,47-/m0/s1 |
| InChIKey | IDGPGLVHZYTLFC-CLDQVZFJSA-N |
| Mol Weight | 810.9 g/mol |
| Molecular Formula | C50H50O10 |
| Exact Mass | 810.340398 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6fIuMmHODvL |
|---|---|
| Name | LESPECYRTIN_H_4 |
| Compound Number | 20 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C50H50O10 |
| InChI | InChI=1S/C50H50O10/c1-24(2)9-12-27-17-32(39(53)21-37(27)51)49-42(34-20-40(54)48-30(46(34)59-49)15-16-50(7,8)60-48)44(56)35-19-31-36-23-57-41-22-38(52)28(13-10-25(3)4)18-33(41)47(36)58-45(31)29(43(35)55)14-11-26(5)6/h9-11,15-22,36,47,51-55H,12-14,23H2,1-8H3/t36-,47-/m0/s1 |
| InChIKey | IDGPGLVHZYTLFC-CLDQVZFJSA-N |
| Literature Reference Author | M.MORI-HONGO,H.YAMAGUCHI,T.WARASHINA,T.MIYASE |
| Literature Reference Citation | J.NAT.PROD.,72,63(2009) |
| Literature Reference DOI | 10.1021/np800535g |
| Molecular Weight | 810.941 g/mol |
| Sample ID | 31335 |
| Solvent | ACETONE-D6 |