| SpectraBase Compound ID | 5v7xZ9eTCTl |
|---|---|
| InChI | InChI=1S/C31H50O4/c1-18-19(2)25-20-9-10-23-28(5)13-12-24(33)27(3,4)22(28)11-14-30(23,7)29(20,6)15-16-31(25,17-21(18)32)26(34)35-8/h9,18-19,21-25,32-33H,10-17H2,1-8H3/t18-,19-,21+,22-,23+,24-,25-,28-,29+,30+,31+/m0/s1 |
| InChIKey | RLPWSZRBGLFXMI-WCKVFBAQSA-N |
| Mol Weight | 486.7 g/mol |
| Molecular Formula | C31H50O4 |
| Exact Mass | 486.37091 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2SNxv3Nsx0C |
|---|---|
| Name | METHYL-3-BETA,21-ALPHA-DIHYDROXY-URS-12-EN-28-OATE |
| Compound Number | 219 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H50O4 |
| InChI | InChI=1S/C31H50O4/c1-18-19(2)25-20-9-10-23-28(5)13-12-24(33)27(3,4)22(28)11-14-30(23,7)29(20,6)15-16-31(25,17-21(18)32)26(34)35-8/h9,18-19,21-25,32-33H,10-17H2,1-8H3/t18-,19-,21+,22-,23+,24-,25-,28-,29+,30+,31+/m0/s1 |
| InChIKey | RLPWSZRBGLFXMI-WCKVFBAQSA-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 | 486.736 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMS5319 |