- 4 of 4 defined stereocentres
2-[(2-Phenylethyl)amino]-5-{[(1R,2S,4aS,8aS)-1,2,4a,5-tetramethyl-1,2,3,4,4a,7,8,8a-octahydro-1-naphthalenyl]methyl}-1,4-benzoquinone
C[C@H]1CC[C@]2([C@H]([C@]1(C)CC3=CC(=O)C(=CC3=O)NCCc4ccccc4)CCC=C2C)C
InChI=1S/C29H37NO2/c1-20-9-8-12-27-28(20,3)15-13-21(2)29(27,4)19-23-17-26(32)24(18-25(23)31)30-16-14-22-10-6-5-7-11-22/h5-7,9-11,17-18,21,27,30H,8,12-16,19H2,1-4H3/t21-,27+,28+,29+/m0/s1
GWBMSBJEYROQOE-XOBBBKNESA-N
CSID:32674830, http://www.chemspider.com/Chemical-Structure.32674830.html (accessed 09:01, Mar 29, 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
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