SpectraBase Compound ID | AL0XPO5G2xr |
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InChI | InChI=1S/C27H42O4/c1-16(28)31-21-14-20-25(4)12-7-11-24(2,3)18(25)10-13-26(20,5)19-9-8-17-15-30-23(29)22(17)27(19,21)6/h8,18-23,29H,7,9-15H2,1-6H3/t18?,19?,20?,21-,22+,23+,25-,26-,27+/m0/s1 |
InChIKey | IDZDIJBVDDHIIM-KQIQMLKBSA-N |
Mol Weight | 430.6 g/mol |
Molecular Formula | C27H42O4 |
Exact Mass | 430.30831 g/mol |
SpectraBase Spectrum ID | LQ0akF3VldI |
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Name | 12-EPIDEOXOSCALARIN |
CAS Registry Number | 64825-83-8 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C27H42O4 |
InChI | InChI=1S/C27H42O4/c1-16(28)31-21-14-20-25(4)12-7-11-24(2,3)18(25)10-13-26(20,5)19-9-8-17-15-30-23(29)22(17)27(19,21)6/h8,18-23,29H,7,9-15H2,1-6H3/t18?,19?,20?,21-,22+,23+,25-,26-,27+/m0/s1 |
InChIKey | IDZDIJBVDDHIIM-KQIQMLKBSA-N |
Literature Reference Author | J.E.HOCHLOWSKI,D.J.FAULKNER,L.S.BASS,J.CLARDY |
Literature Reference Citation | J.ORG.CHEM.,48,1738(1983) |
Literature Reference DOI | 10.1021/jo00158a030 |
Molecular Weight | 430.628 g/mol |
Solvent | CDCl3 |
Source File Reference | UNIW11699 |