| SpectraBase Compound ID | 2T6VHlNUNQh |
|---|---|
| InChI | InChI=1S/C30H44N4O2S/c1-27-14-6-15-28(2,25(35)36)23(27)13-16-30-17-21(9-12-24(27)30)29(3,19-30)32-26(37)33-31-18-20-7-10-22(11-8-20)34(4)5/h7-8,10-11,18,21,23-24H,6,9,12-17,19H2,1-5H3,(H,35,36)(H2,32,33,37)/b31-18+/t21-,23+,24+,27-,28-,29-,30+/m1/s1 |
| InChIKey | PWDCGWHQJNSZSI-BRSGTFRFSA-N |
| Mol Weight | 524.8 g/mol |
| Molecular Formula | C30H44N4O2S |
| Exact Mass | 524.318498 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 3MnBEYJ7GIg |
|---|---|
| Name | N1-(E)-(4-DIMETHYLAMINOPHENYL)-N4-(ENT-KAUREN-16-BETA-METHYL-19-OIC-ACID)-THIOSEMICARBAZONE |
| Compound Number | 9 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H44N4O2S |
| InChI | InChI=1S/C30H44N4O2S/c1-27-14-6-15-28(2,25(35)36)23(27)13-16-30-17-21(9-12-24(27)30)29(3,19-30)32-26(37)33-31-18-20-7-10-22(11-8-20)34(4)5/h7-8,10-11,18,21,23-24H,6,9,12-17,19H2,1-5H3,(H,35,36)(H2,32,33,37)/b31-18+/t21-,23+,24+,27-,28-,29-,30+/m1/s1 |
| InChIKey | PWDCGWHQJNSZSI-BRSGTFRFSA-N |
| Literature Reference Author | S.K.HARAGUCHI,A.A.SILVA,G.J.VIDOTTI,P.V.DOSSANTOS,F.P.GARCIA ,R.B.PEDROSO,C.V.NAK |
| Literature Reference Citation | MOLECULES,16,1166(2011) |
| Literature Reference DOI | 10.3390/molecules16021166 |
| Molecular Weight | 524.765 g/mol |
| Sample ID | 90 |
| Solvent | DMSO-D6 |