| SpectraBase Compound ID | 47R043ZDDpB |
|---|---|
| InChI | InChI=1S/C58H94O27/c1-53(2)14-15-58(52(74)75)24(16-53)23-8-9-31-55(5)12-11-33(54(3,4)30(55)10-13-56(31,6)57(23,7)17-32(58)64)81-51-46(85-48-40(71)37(68)35(66)27(18-59)78-48)43(26(63)22-77-51)82-49-41(72)38(69)44(29(20-61)80-49)83-50-42(73)45(36(67)28(19-60)79-50)84-47-39(70)34(65)25(62)21-76-47/h8,24-51,59-73H,9-22H2,1-7H3,(H,74,75)/t24?,25-,26-,27-,28-,29+,30?,31?,32-,33+,34+,35-,36+,37+,38+,39-,40-,41+,42-,43-,44+,45+,46+,47+,48+,49+,50+,51-,55+,56-,57-,58-/m1/s1 |
| InChIKey | QZEMMSOXVCENHK-VNQQFHHTSA-N |
| Mol Weight | 1223.4 g/mol |
| Molecular Formula | C58H94O27 |
| Exact Mass | 1222.598248 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LAOsn3soXRZ |
|---|---|
| Name | PROSAPOGENIN-3A |
| Compound Number | 3A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C58H94O27 |
| InChI | InChI=1S/C58H94O27/c1-53(2)14-15-58(52(74)75)24(16-53)23-8-9-31-55(5)12-11-33(54(3,4)30(55)10-13-56(31,6)57(23,7)17-32(58)64)81-51-46(85-48-40(71)37(68)35(66)27(18-59)78-48)43(26(63)22-77-51)82-49-41(72)38(69)44(29(20-61)80-49)83-50-42(73)45(36(67)28(19-60)79-50)84-47-39(70)34(65)25(62)21-76-47/h8,24-51,59-73H,9-22H2,1-7H3,(H,74,75)/t24?,25-,26-,27-,28-,29+,30?,31?,32-,33+,34+,35-,36+,37+,38+,39-,40-,41+,42-,43-,44+,45+,46+,47+,48+,49+,50+,51-,55+,56-,57-,58-/m1/s1 |
| InChIKey | QZEMMSOXVCENHK-VNQQFHHTSA-N |
| Literature Reference Author | M.CHEN,W.W.WU,O.STICHER,D.NANZ |
| Literature Reference Citation | J.NAT.PROD.,59,722(1996) |
| Literature Reference DOI | 10.1021/np960185g |
| Molecular Weight | 1223.368 g/mol |
| Solvent | PYRIDINE-D5:CD3OD |
| Source File Reference | UWVP933 |