SpectraBase Compound ID | BDZxVQu8Wb4 |
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InChI | InChI=1S/C30H46O4/c1-18(2)19-9-14-30(25(33)34)16-15-28(5)20(24(19)30)7-8-22-26(3)12-11-23(32)27(4,17-31)21(26)10-13-29(22,28)6/h19-22,24,31H,1,7-17H2,2-6H3,(H,33,34)/t19-,20?,21?,22?,24?,26-,27-,28+,29+,30-/m0/s1 |
InChIKey | FRBHXYYJMYBCSK-KCTMBPGNSA-N |
Mol Weight | 470.7 g/mol |
Molecular Formula | C30H46O4 |
Exact Mass | 470.33961 g/mol |
SpectraBase Spectrum ID | BfYVjUKdd9L |
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Name | PULSATILLIC-ACID;3-OXO-23-HYDROXY-LUP-20(29)-EN-28-OIC-ACID |
Compound Number | 2 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C30H46O4 |
InChI | InChI=1S/C30H46O4/c1-18(2)19-9-14-30(25(33)34)16-15-28(5)20(24(19)30)7-8-22-26(3)12-11-23(32)27(4,17-31)21(26)10-13-29(22,28)6/h19-22,24,31H,1,7-17H2,2-6H3,(H,33,34)/t19-,20?,21?,22?,24?,26-,27-,28+,29+,30-/m0/s1 |
InChIKey | FRBHXYYJMYBCSK-KCTMBPGNSA-N |
Literature Reference Author | W.C.YE,N.N.JI,S.X.ZHAO,J.H.LIU,T.YE,M.A.MCKERVEY,P.STEVENSON |
Literature Reference Citation | PHYTOCHEM.,42,799(1996) |
Literature Reference DOI | 10.1016/0031-9422(96)00043-X |
Molecular Weight | 470.693 g/mol |
Solvent | C5D5N |
Source File Reference | UWLU3599 |