| SpectraBase Compound ID | F6oFgeE7Eaz |
|---|---|
| InChI | InChI=1S/C55H94N2O18/c1-35(16-36(2)17-54(73)57-52(53(75-3)32-55(57)74)18-37-13-9-7-10-14-37)12-8-5-4-6-11-15-38(59)19-39(60)20-40(61)21-41(62)22-42(63)23-43(64)24-44(65)25-45(66)26-46(67)27-47(68)28-48(69)29-49(70)30-50(71)31-51(72)33-56-34-58/h7,9-10,13-14,17,32,34-35,38-52,59-72H,4-6,8,11-12,15-16,18-31,33H2,1-3H3,(H,56,58)/b36-17-/t35?,38-,39+,40+,41+,42+,43+,44+,45+,46+,47+,48+,49+,50+,51-,52+/m1/s1 |
| InChIKey | FUTYOFOJXUHBDE-SERSHNLTSA-N |
| Mol Weight | 1071.4 g/mol |
| Molecular Formula | C55H94N2O18 |
| Exact Mass | 1070.650164 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5GSqkLV7fx2 |
|---|---|
| Name | MYCAPOLYOL-A |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C55H94N2O18 |
| InChI | InChI=1S/C55H94N2O18/c1-35(16-36(2)17-54(73)57-52(53(75-3)32-55(57)74)18-37-13-9-7-10-14-37)12-8-5-4-6-11-15-38(59)19-39(60)20-40(61)21-41(62)22-42(63)23-43(64)24-44(65)25-45(66)26-46(67)27-47(68)28-48(69)29-49(70)30-50(71)31-51(72)33-56-34-58/h7,9-10,13-14,17,32,34-35,38-52,59-72H,4-6,8,11-12,15-16,18-31,33H2,1-3H3,(H,56,58)/b36-17-/t35?,38-,39+,40+,41+,42+,43+,44+,45+,46+,47+,48+,49+,50+,51-,52+/m1/s1 |
| InChIKey | FUTYOFOJXUHBDE-SERSHNLTSA-N |
| Literature Reference Author | P.PHUWAPRAISIRISAN,S.MATSUNAGA,N.FUSETANI |
| Literature Reference Citation | ORG.LETTERS,7,2233(2005) |
| Literature Reference DOI | 10.1021/ol050648m |
| Molecular Weight | 1071.354 g/mol |
| Sample ID | 42885 |
| Solvent | DMSO-D6 |