| SpectraBase Spectrum ID |
CfteK1qrFH2 |
| Name |
(2-S,3-R,4-R,4A-S,4B-R,6A-S,12B-S,12C-S,14A-S)-4A-DEMETHYLPASPALINE-3,4,4A-TRIOL |
| Compound Number |
3 |
| Copyright |
Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula |
C27H37NO5 |
| InChI |
InChI=1S/C27H37NO5/c1-24(2,31)23-20(29)22(30)27(32)18-10-9-14-13-16-15-7-5-6-8-17(15)28-21(16)26(14,4)25(18,3)12-11-19(27)33-23/h5-8,14,18-20,22-23,28-32H,9-13H2,1-4H3/t14-,18+,19-,20+,22+,23-,25-,26+,27+/m0/s1 |
| InChIKey |
LQDPZVYIZKOAPV-BCHUPDFZSA-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 |
455.594 g/mol |
| Sample ID |
42797 |
| Solvent |
DMSO-D6 |
