SpectraBase Compound ID | 8rhysJocwU8 |
---|---|
InChI | InChI=1S/C23H28O12/c1-9-14(33-21(31)10-3-2-4-11(25)5-10)6-12-13(20(29)30)8-32-22(16(9)12)35-23-19(28)18(27)17(26)15(7-24)34-23/h2-5,8-9,12,14-19,22-28H,6-7H2,1H3,(H,29,30)/t9-,12+,14+,15-,16+,17-,18+,19-,22-,23+/m0/s1 |
InChIKey | BSMWQZICWPFTBG-SQEZSCGBSA-N |
Mol Weight | 496.47 g/mol |
Molecular Formula | C23H28O12 |
Exact Mass | 496.158076 g/mol |
SpectraBase Spectrum ID | GNbged4rIU9 |
---|---|
Name | SWERTIASIDE;7-EPI-(META-HYDROXYBENZOYL)-LOGANIC_ACID |
Compound Number | 180 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C23H28O12 |
InChI | InChI=1S/C23H28O12/c1-9-14(33-21(31)10-3-2-4-11(25)5-10)6-12-13(20(29)30)8-32-22(16(9)12)35-23-19(28)18(27)17(26)15(7-24)34-23/h2-5,8-9,12,14-19,22-28H,6-7H2,1H3,(H,29,30)/t9-,12+,14+,15-,16+,17-,18+,19-,22-,23+/m0/s1 |
InChIKey | BSMWQZICWPFTBG-SQEZSCGBSA-N |
Literature Reference Author | C.A.BOROS,F.R.STERMITZ |
Literature Reference Citation | J.NAT.PROD.,53,1055(1990) |
Literature Reference DOI | 10.1021/np50071a001 |
Molecular Weight | 496.468 g/mol |
Solvent | CD3OD |
Source File Reference | UWMZ16162 |