| SpectraBase Compound ID | CoE2zOqgEjG |
|---|---|
| InChI | InChI=1S/C29H48O3/c1-18(2)21(5)19(3)16-20(4)23-8-9-24-26(23,6)12-11-25-27(7)13-10-22(30)17-28(27)14-15-29(24,25)32-31-28/h14-15,18-25,30H,8-13,16-17H2,1-7H3/t19-,20-,21+,22+,23-,24-,25-,26?,27?,28-,29+/m1/s1 |
| InChIKey | ZCQZIDOFCDVBNA-ZWBKFUDTSA-N |
| Mol Weight | 444.7 g/mol |
| Molecular Formula | C29H48O3 |
| Exact Mass | 444.360345 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CD5HOLZJCoZ |
|---|---|
| Name | TOPSENTISTEROL_A2 |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H48O3 |
| InChI | InChI=1S/C29H48O3/c1-18(2)21(5)19(3)16-20(4)23-8-9-24-26(23,6)12-11-25-27(7)13-10-22(30)17-28(27)14-15-29(24,25)32-31-28/h14-15,18-25,30H,8-13,16-17H2,1-7H3/t19-,20-,21+,22+,23-,24-,25-,26?,27?,28-,29+/m1/s1 |
| InChIKey | ZCQZIDOFCDVBNA-ZWBKFUDTSA-N |
| Literature Reference Author | X.LUO,F.LI,P.B.SHINDE,J.HONG,C.O.LEE,K.S.IM,J.H.JUNG |
| Literature Reference Citation | J.NAT.PROD.,69,1760(2006) |
| Literature Reference DOI | 10.1021/np0604026 |
| Molecular Weight | 444.698 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWMZ17632 |