For research use only. Not for therapeutic Use.
Regelidine is a natural product isolated from the stems of Tripterygium regelii[1].
Catalog Number | I016758 |
CAS Number | 114542-54-0 |
Synonyms | [(1S,2S,5S,6S,7S,9R)-5,7-dibenzoyloxy-2-hydroxy-2,6,10,10-tetramethyl-11-oxatricyclo[7.2.1.01,6]dodecan-12-yl] pyridine-3-carboxylate |
Molecular Formula | C35H37NO8 |
Purity | ≥95% |
InChI | InChI=1S/C35H37NO8/c1-32(2)25-20-27(42-30(38)23-14-9-6-10-15-23)34(4)26(41-29(37)22-12-7-5-8-13-22)17-18-33(3,40)35(34,44-32)28(25)43-31(39)24-16-11-19-36-21-24/h5-16,19,21,25-28,40H,17-18,20H2,1-4H3/t25-,26+,27+,28?,33+,34+,35+/m1/s1 |
InChIKey | MZSHQEJWMYSZEP-RUPBAICDSA-N |
SMILES | CC1(C2CC(C3(C(CCC(C3(C2OC(=O)C4=CN=CC=C4)O1)(C)O)OC(=O)C5=CC=CC=C5)C)OC(=O)C6=CC=CC=C6)C |
Reference | [1]. Fan, D., et al. Dihydro-β-agarofuran sesquiterpene polyesters isolated from the stems of Tripterygium regelii. Fitoterapia, 2016;112, 1–8. |