| SpectraBase Compound ID | 4M9OsMOsvB5 |
|---|---|
| InChI | InChI=1S/C30H50O3/c1-17(2)20(18(3)4)9-8-19(5)22-10-11-23-21-14-26(31)25-15-27(32)28(33)16-30(25,7)24(21)12-13-29(22,23)6/h8-9,18-28,31-33H,1,10-16H2,2-7H3/b9-8-/t19?,20?,21?,22-,23?,24?,25?,26?,27?,28+,29-,30-/m1/s1 |
| InChIKey | NUYXLGWLOXEOIP-LNXOTYPGSA-N |
| Mol Weight | 458.7 g/mol |
| Molecular Formula | C30H50O3 |
| Exact Mass | 458.375995 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Fn5N6rQO4aZ |
|---|---|
| Name | POLASTEROL-B;24-EPSILON-ISOPROPENYLCHOLESTA-22(Z),28(29)-DIENE-2-BETA,3-ALPHA,6-ALPHA-TRIOL |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H50O3 |
| InChI | InChI=1S/C30H50O3/c1-17(2)20(18(3)4)9-8-19(5)22-10-11-23-21-14-26(31)25-15-27(32)28(33)16-30(25,7)24(21)12-13-29(22,23)6/h8-9,18-28,31-33H,1,10-16H2,2-7H3/b9-8-/t19?,20?,21?,22-,23?,24?,25?,26?,27?,28+,29-,30-/m1/s1 |
| InChIKey | NUYXLGWLOXEOIP-LNXOTYPGSA-N |
| Literature Reference Author | A.UMEYAMA,K.ADACHI,S.ITO,S.ARIHARA |
| Literature Reference Citation | J.NAT.PROD.,63,1175(2000) |
| Literature Reference DOI | 10.1021/np000024j |
| Molecular Weight | 458.725 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWRU2120 |