SpectraBase Compound ID | 1LG65D8tybA |
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InChI | InChI=1S/C28H42O3/c1-18(2)19(3)7-8-20(4)22-9-10-23-25(22,5)13-12-24-26(6)14-11-21(29)17-27(26)15-16-28(23,24)31-30-27/h7-8,15-16,19-24,29H,1,9-14,17H2,2-6H3/b8-7+/t19-,20-,21+,22-,23-,24-,25-,26-,27-,28+/m1/s1 |
InChIKey | MSFASZXZLNRTBR-LBMRXTFASA-N |
Mol Weight | 426.6 g/mol |
Molecular Formula | C28H42O3 |
Exact Mass | 426.313395 g/mol |
SpectraBase Spectrum ID | KssWFnZpPrX |
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Name | AXINYSTEROL |
Compound Number | 3 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C28H42O3 |
InChI | InChI=1S/C28H42O3/c1-18(2)19(3)7-8-20(4)22-9-10-23-25(22,5)13-12-24-26(6)14-11-21(29)17-27(26)15-16-28(23,24)31-30-27/h7-8,15-16,19-24,29H,1,9-14,17H2,2-6H3/b8-7+/t19-,20-,21+,22-,23-,24-,25-,26-,27-,28+/m1/s1 |
InChIKey | MSFASZXZLNRTBR-LBMRXTFASA-N |
Literature Reference Author | M.IWASHIMA,I.TERADA,K.IGUCHI,T.YAMORI |
Literature Reference Citation | CHEM.PHARM.BULL.,50,1286(2002) |
Literature Reference DOI | 10.1248/cpb.50.1286 |
Molecular Weight | 426.640 g/mol |
Solvent | CDCl3 |
Source File Reference | UWMS20028 |