| SpectraBase Compound ID | LD2J5YgmAiU |
|---|---|
| InChI | InChI=1S/C38H59NO9/c1-22-12-17-38(32(44)39-26(20-40)31(43)46-9)19-18-35(6)25(30(38)37(22,8)45)10-11-28-33(4)15-14-29(48-24(3)42)34(5,21-47-23(2)41)27(33)13-16-36(28,35)7/h10,22,26-30,40,45H,11-21H2,1-9H3,(H,39,44)/t22-,26?,27-,28-,29+,30-,33+,34+,35-,36-,37-,38+/m1/s1 |
| InChIKey | OHDUTMGGRSGZOZ-CPFYHMRRSA-N |
| Mol Weight | 673.9 g/mol |
| Molecular Formula | C38H59NO9 |
| Exact Mass | 673.418982 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | El63KnSVLM |
|---|---|
| Name | METHYL-N-(3-BETA,23-DIACETOXY-19-ALPHA-HYDROXY-URS-12-EN-28-OYL)-2-AMINO-3-HYDROXY-PROPIONATE |
| Compound Number | 5A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C38H59NO9 |
| InChI | InChI=1S/C38H59NO9/c1-22-12-17-38(32(44)39-26(20-40)31(43)46-9)19-18-35(6)25(30(38)37(22,8)45)10-11-28-33(4)15-14-29(48-24(3)42)34(5,21-47-23(2)41)27(33)13-16-36(28,35)7/h10,22,26-30,40,45H,11-21H2,1-9H3,(H,39,44)/t22-,26?,27-,28-,29+,30-,33+,34+,35-,36-,37-,38+/m1/s1 |
| InChIKey | OHDUTMGGRSGZOZ-CPFYHMRRSA-N |
| Literature Reference Author | Y.F.HE,M.L.NAN,J.M.SUN,Z.J.MENG,F.G.YUE,Q.C.ZHAO,X.H.YANG,H. WANG |
| Literature Reference Citation | MOLECULES,17,1278(2012) |
| Literature Reference DOI | 10.3390/molecules17021278 |
| Molecular Weight | 673.888 g/mol |
| Sample ID | 73099 |
| Solvent | C5D5N |