SpectraBase Compound ID | Dgvj9EGYRsd |
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InChI | InChI=1S/C29H36O7/c1-25-6-7-26(2,24(35)36)14-19(25)29(5)11-9-27(3)15-12-17(31)22(32)21(23(33)34)20(15)16(30)13-18(27)28(29,4)10-8-25/h12-13,19,31-32H,6-11,14H2,1-5H3,(H,33,34)(H,35,36)/t19-,25-,26-,27+,28-,29+/m1/s1 |
InChIKey | IGEUWSSSLAVCIX-GPQUBRLFSA-N |
Mol Weight | 496.6 g/mol |
Molecular Formula | C29H36O7 |
Exact Mass | 496.246103 g/mol |
SpectraBase Spectrum ID | KuXiXQzj3DO |
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Name | DEMETHYLZEYLASTERONE |
Compound Number | 5 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C29H36O7 |
InChI | InChI=1S/C29H36O7/c1-25-6-7-26(2,24(35)36)14-19(25)29(5)11-9-27(3)15-12-17(31)22(32)21(23(33)34)20(15)16(30)13-18(27)28(29,4)10-8-25/h12-13,19,31-32H,6-11,14H2,1-5H3,(H,33,34)(H,35,36)/t19-,25-,26-,27+,28-,29+/m1/s1 |
InChIKey | IGEUWSSSLAVCIX-GPQUBRLFSA-N |
Literature Reference Author | T.MOROTA,C.X.YANG,T.OGINO,W.Z.QIN,T.KATSUHARA,L.H.XU,Y.KOMAT SU,K.L.MIAO,M.MARUNO |
Literature Reference Citation | PHYTOCHEM.,39,1159(1995) |
Literature Reference DOI | 10.1016/0031-9422(94)00916-H |
Molecular Weight | 496.601 g/mol |
Solvent | CD3OD |
Source File Reference | UWMZ7775 |