| SpectraBase Compound ID | 9BO6Dg9abey |
|---|---|
| InChI | InChI=1S/C37H57NO5/c1-6-42-32-20-29-26-13-14-28-34(40)31(39)17-19-36(28,4)27(26)16-18-37(29,5)33(32)24(3)30-15-12-23(2)21-38(30)35(41)43-22-25-10-8-7-9-11-25/h7-11,23-24,26-34,39-40H,6,12-22H2,1-5H3/t23-,24-,26-,27+,28+,29+,30-,31+,32+,33+,34-,36-,37+/m1/s1 |
| InChIKey | NJSYVXZSISCBQA-RVFQPGOLSA-N |
| Mol Weight | 595.9 g/mol |
| Molecular Formula | C37H57NO5 |
| Exact Mass | 595.423674 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2vWy0UD4AxS |
|---|---|
| Name | (22S,25R)-16-BETA-ETHOXY-22,26-N-CBZ-EPIMINO-5-ALPHA-CHOLESTANE-3-BETA,4-BETA-DIOL |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C37H57NO5 |
| InChI | InChI=1S/C37H57NO5/c1-6-42-32-20-29-26-13-14-28-34(40)31(39)17-19-36(28,4)27(26)16-18-37(29,5)33(32)24(3)30-15-12-23(2)21-38(30)35(41)43-22-25-10-8-7-9-11-25/h7-11,23-24,26-34,39-40H,6,12-22H2,1-5H3/t23-,24-,26-,27+,28+,29+,30-,31+,32+,33+,34-,36-,37+/m1/s1 |
| InChIKey | NJSYVXZSISCBQA-RVFQPGOLSA-N |
| Literature Reference Author | E.VILORIA,G.MECCIA,A.N.USUBILLAGA |
| Literature Reference Citation | J.NAT.PROD.,55,1178(1992) |
| Literature Reference DOI | 10.1021/np50087a003 |
| Molecular Weight | 595.863 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWTS427 |