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- Double-bond stereo
- 1 of 1 defined stereocentres
(2E)-3-{5-[(2,4-Diamino-5-pyrimidinyl)methyl]-2,3-dimethoxyphenyl}-1-[(1S)-1-phenyl-2(1H)-phthalazinyl]-2-propen-1-one
COc1cc(cc(c1OC)/C=C/C(=O)N2C(c3ccccc3C=N2)c4ccccc4)Cc5cnc(nc5N)N
InChI=1S/C30H28N6O3/c1-38-25-16-19(15-23-17-33-30(32)35-29(23)31)14-21(28(25)39-2)12-13-26(37)36-27(20-8-4-3-5-9-20)24-11-7-6-10-22(24)18-34-36/h3-14,16-18,27H,15H2,1-2H3,(H4,31,32,33,35)/b13-12+/t27-/m0/s1
NFQBNKYRVDDBSW-QSRYBZNWSA-N
CSID:35035056, http://www.chemspider.com/Chemical-Structure.35035056.html (accessed 07:53, Apr 26, 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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