Try beta.chemspider
- 3 of 3 defined stereocentres
(3aR,6R,7aS)-7a-(1,3-Benzodioxol-5-yl)-3a-(ethylsulfanyl)-6-methoxy-1-(phenylsulfonyl)-2,3,3a,6,7,7a-hexahydro-1H-indole
CCS[C@@]12CCN([C@@]1(C[C@H](C=C2)OC)c3ccc4c(c3)OCO4)S(=O)(=O)c5ccccc5
InChI=1S/C24H27NO5S2/c1-3-31-23-12-11-19(28-2)16-24(23,18-9-10-21-22(15-18)30-17-29-21)25(14-13-23)32(26,27)20-7-5-4-6-8-20/h4-12,15,19H,3,13-14,16-17H2,1-2H3/t19-,23-,24-/m0/s1
NDRNLRJMMYWAGO-IGKWTDBASA-N
CSID:30658580, http://www.chemspider.com/Chemical-Structure.30658580.html (accessed 13:35, Jul 1, 2024)
Validated by Experts, Validated by Users, Non-Validated, Removed by Users
Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00
Click to predict properties on the Chemicalize site
Advertisement
Spotlight