| SpectraBase Compound ID | DWLvaqssIHS |
|---|---|
| InChI | InChI=1S/C29H44O2/c1-25(2)13-10-18-19(16-25)20-8-9-23-27(5)14-12-24(31)26(3,4)22(27)11-15-28(23,6)29(20,7)17-21(18)30/h8,22-24,31H,9-17H2,1-7H3/t22-,23+,24-,27-,28+,29+/m0/s1 |
| InChIKey | YBMSCCGVVSSARE-WAJDCHDJSA-N |
| Mol Weight | 424.7 g/mol |
| Molecular Formula | C29H44O2 |
| Exact Mass | 424.334131 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JRXo6dOLsYc |
|---|---|
| Name | MARAGENIN-II;3-BETA-HYDROXY-28-NOR-OLEANA-12,17-DIEN-16-ONE |
| Compound Number | 143 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H44O2 |
| InChI | InChI=1S/C29H44O2/c1-25(2)13-10-18-19(16-25)20-8-9-23-27(5)14-12-24(31)26(3,4)22(27)11-15-28(23,6)29(20,7)17-21(18)30/h8,22-24,31H,9-17H2,1-7H3/t22-,23+,24-,27-,28+,29+/m0/s1 |
| InChIKey | YBMSCCGVVSSARE-WAJDCHDJSA-N |
| Literature Reference Author | S.B.MAHATO,A.P.KUNDU |
| Literature Reference Citation | PHYTOCHEM.,37,1517(1994) |
| Literature Reference DOI | 10.1016/S0031-9422(00)89569-2 |
| Molecular Weight | 424.667 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMS5243 |