| SpectraBase Spectrum ID |
KzqZ07sP2h8 |
| Name |
(2-S,4A-R,4B-R,6A-S,12B-S,12C-S,14A-S)-4A-DEMETHYLPASPALINE-4A-CARBOXYLIC_ACID |
| Compound Number |
2 |
| Copyright |
Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula |
C28H37NO4 |
| InChI |
InChI=1S/C28H37NO4/c1-25(2,32)21-12-14-28(24(30)31)20-10-9-16-15-18-17-7-5-6-8-19(17)29-23(18)27(16,4)26(20,3)13-11-22(28)33-21/h5-8,16,20-22,29,32H,9-15H2,1-4H3,(H,30,31)/t16-,20+,21-,22-,26-,27+,28+/m0/s1 |
| InChIKey |
QHCUDWQJVPGPRW-JKEWKBHPSA-N |
| Literature Reference Author |
Y.FAN,Y.WANG,P.LIU,P.FU,T.ZHU,W.WANG,W.ZHU |
| Literature Reference Citation |
J.NAT.PROD.,76,1328(2013) |
| Literature Reference DOI |
10.1021/np400304q |
| Molecular Weight |
451.606 g/mol |
| Sample ID |
42796 |
| Solvent |
DMSO-D6 |
