SpectraBase Compound ID | 1cnvBYnYUaa |
---|---|
InChI | InChI=1S/C26H37NO8/c1-12(28)34-19-14-9-15-18(19)24(32-5,10-16(14)31-4)26(33-6)21(35-13(2)29)20-23(3)8-7-17(30)25(15,20)22(26)27-11-23/h14-16,18-22,27H,7-11H2,1-6H3/t14-,15?,16+,18?,19+,20?,21-,22?,23+,24-,25+,26-/m1/s1 |
InChIKey | KHLANGIAWTYCRD-BPNCYWCRSA-N |
Mol Weight | 491.6 g/mol |
Molecular Formula | C26H37NO8 |
Exact Mass | 491.251917 g/mol |
SpectraBase Spectrum ID | AiXnaLmToKy |
---|---|
Name | PERGILONE |
Compound Number | 2 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C26H37NO8 |
InChI | InChI=1S/C26H37NO8/c1-12(28)34-19-14-9-15-18(19)24(32-5,10-16(14)31-4)26(33-6)21(35-13(2)29)20-23(3)8-7-17(30)25(15,20)22(26)27-11-23/h14-16,18-22,27H,7-11H2,1-6H3/t14-,15?,16+,18?,19+,20?,21-,22?,23+,24-,25+,26-/m1/s1 |
InChIKey | KHLANGIAWTYCRD-BPNCYWCRSA-N |
Literature Reference Author | A.ULUBELEN,A.H.MERICLI,F.MERICLI,R.ILARSLAN |
Literature Reference Citation | PHYTOCHEM.,31,1019(1992) |
Literature Reference DOI | 10.1016/0031-9422(92)80061-i |
Molecular Weight | 491.582 g/mol |
Solvent | CDCl3 |
Source File Reference | UWVN5024 |