| SpectraBase Compound ID | JbG8f9SQYyT |
|---|---|
| InChI | InChI=1S/C31H50O6/c1-26(2)12-14-31(25(36)37-7)15-13-28(4)18(19(31)16-26)8-9-21-29(28,5)11-10-20-27(3,17-32)23(34)22(33)24(35)30(20,21)6/h8,19-24,32-35H,9-17H2,1-7H3/t19-,20-,21-,22-,23-,24+,27-,28+,29+,30-,31-/m0/s1 |
| InChIKey | WOAJSSFTWYFPGN-ODGZAWGKSA-N |
| Mol Weight | 518.7 g/mol |
| Molecular Formula | C31H50O6 |
| Exact Mass | 518.360739 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 20gNA9sozlI |
|---|---|
| Name | MUCUNAGENIN-A;METHYL-1-BETA,2-ALPHA,3-BETA,23-TETRAHYDROXY-OLEAN-12-EN-28-OATE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H50O6 |
| InChI | InChI=1S/C31H50O6/c1-26(2)12-14-31(25(36)37-7)15-13-28(4)18(19(31)16-26)8-9-21-29(28,5)11-10-20-27(3,17-32)23(34)22(33)24(35)30(20,21)6/h8,19-24,32-35H,9-17H2,1-7H3/t19-,20-,21-,22-,23-,24+,27-,28+,29+,30-,31-/m0/s1 |
| InChIKey | WOAJSSFTWYFPGN-ODGZAWGKSA-N |
| Literature Reference Author | Y.DING,J.KINJO,C.R.YANG,T.NOHARA |
| Literature Reference Citation | PHYTOCHEM.,30,3703(1991) |
| Literature Reference DOI | 10.1016/0031-9422(91)80094-H |
| Molecular Weight | 518.734 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMS27212 |