| SpectraBase Compound ID | 7bMUQc9rYbe |
|---|---|
| InChI | InChI=1S/C49H76O20/c1-21-29(53)31(55)33(57)40(64-21)67-36-35(59)37(39(60)63-8)68-42(38(36)69-41-34(58)32(56)30(54)24(19-50)65-41)66-28-12-13-45(4)25(46(28,5)20-51)11-14-47(6)26(45)10-9-22-23-17-44(2,3)15-16-49(23,43(61)62)27(52)18-48(22,47)7/h9,20-21,23-38,40-42,50,52-59H,10-19H2,1-8H3,(H,61,62)/t21-,23?,24-,25?,26?,27-,28+,29-,30+,31+,32+,33+,34-,35-,36-,37-,38+,40-,41+,42+,45+,46+,47-,48-,49-/m1/s1 |
| InChIKey | IDBKUVJFZJQDPM-ZBAVUXLBSA-N |
| Mol Weight | 985.1 g/mol |
| Molecular Formula | C49H76O20 |
| Exact Mass | 984.492995 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | I6pK7roK1Fu |
|---|---|
| Name | IDBKUVJFZJQDPM-ZBAVUXLBSA-N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C49H76O20 |
| InChI | InChI=1S/C49H76O20/c1-21-29(53)31(55)33(57)40(64-21)67-36-35(59)37(39(60)63-8)68-42(38(36)69-41-34(58)32(56)30(54)24(19-50)65-41)66-28-12-13-45(4)25(46(28,5)20-51)11-14-47(6)26(45)10-9-22-23-17-44(2,3)15-16-49(23,43(61)62)27(52)18-48(22,47)7/h9,20-21,23-38,40-42,50,52-59H,10-19H2,1-8H3,(H,61,62)/t21-,23?,24-,25?,26?,27-,28+,29-,30+,31+,32+,33+,34-,35-,36-,37-,38+,40-,41+,42+,45+,46+,47-,48-,49-/m1/s1 |
| InChIKey | IDBKUVJFZJQDPM-ZBAVUXLBSA-N |
| Literature Reference Author | M.IWAMOTO,H.OKABE,T.YAMAUCHI,M.TANAKA,Y.ROKUTANI,S.HARA,K.MI HASHI,R.HIGUCHI |
| Literature Reference Citation | CHEM.PHARM.BULL.,33,464(1985) |
| Literature Reference DOI | 10.1248/cpb.33.464 |
| Molecular Weight | 985.130 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWBK133 |