SpectraBase Compound ID | 74nSxwHzEan |
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InChI | InChI=1S/C30H46O3/c1-18-10-15-30(25(32)33)17-16-28(6)20(24(30)19(18)2)8-9-22-27(5)13-12-23(31)26(3,4)21(27)11-14-29(22,28)7/h8,18-19,21-22,24H,9-17H2,1-7H3,(H,32,33)/t18-,19+,21+,22-,24+,27+,28-,29-,30+/m1/s1 |
InChIKey | MUCRYNWJQNHDJH-OADIDDRXSA-N |
Mol Weight | 454.7 g/mol |
Molecular Formula | C30H46O3 |
Exact Mass | 454.344695 g/mol |
SpectraBase Spectrum ID | 4wcFyN48vCI |
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Name | URSONIC-ACID;3-OXO-URS-12-EN-28-OIC-ACID |
Compound Number | 2 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C30H46O3 |
InChI | InChI=1S/C30H46O3/c1-18-10-15-30(25(32)33)17-16-28(6)20(24(30)19(18)2)8-9-22-27(5)13-12-23(31)26(3,4)21(27)11-14-29(22,28)7/h8,18-19,21-22,24H,9-17H2,1-7H3,(H,32,33)/t18-,19+,21+,22-,24+,27+,28-,29-,30+/m1/s1 |
InChIKey | MUCRYNWJQNHDJH-OADIDDRXSA-N |
Literature Reference Author | A.IBRAHIM,S.I.KHALIFA,I.KHAFAGI,D.T.YOUSSEF,S.KHAN,M.MESBAH, I.KHAN |
Literature Reference Citation | CHEM.PHARM.BULL.,56,1253(2008) |
Literature Reference DOI | 10.1248/cpb.56.1253 |
Molecular Weight | 454.693 g/mol |
Sample ID | 2108 |
Solvent | C5D5N |