| SpectraBase Compound ID | 2Qft9AZM1XV |
|---|---|
| InChI | InChI=1S/C36H60O7/c1-31(2)15-16-33(5)21(17-31)20-9-10-24-34(6)13-12-26(43-30-29(41)28(40)27(39)22(19-37)42-30)32(3,4)23(34)11-14-35(24,7)36(20,8)18-25(33)38/h9,21-30,37-41H,10-19H2,1-8H3/t21?,22-,23?,24?,25?,26?,27+,28+,29-,30+,33?,34+,35-,36-/m1/s1 |
| InChIKey | CMJSPYRRAOQTJB-JPUZLDEWSA-N |
| Mol Weight | 604.9 g/mol |
| Molecular Formula | C36H60O7 |
| Exact Mass | 604.433904 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 24omgK4Kkpr |
|---|---|
| Name | SIGMOISIDE-B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H60O7 |
| InChI | InChI=1S/C36H60O7/c1-31(2)15-16-33(5)21(17-31)20-9-10-24-34(6)13-12-26(43-30-29(41)28(40)27(39)22(19-37)42-30)32(3,4)23(34)11-14-35(24,7)36(20,8)18-25(33)38/h9,21-30,37-41H,10-19H2,1-8H3/t21?,22-,23?,24?,25?,26?,27+,28+,29-,30+,33?,34+,35-,36-/m1/s1 |
| InChIKey | CMJSPYRRAOQTJB-JPUZLDEWSA-N |
| Literature Reference Author | J.KOUAM,A.E.NKENGFACK,Z.T.FOMUM,R.UBILLAS,M.S.TEMPESTA,M.MEY ER |
| Literature Reference Citation | J.NAT.PROD.,54,1288(1991) |
| Literature Reference DOI | 10.1021/np50077a008 |
| Molecular Weight | 604.868 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWTS811 |