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- 7 of 7 defined stereocentres
(11beta)-11,17-Dihydroxy-3,20-dioxopregn-4-en-21-yl 4-({4-[(1,4-dioxo-1,2,3,4-tetrahydro-6-phthalazinyl)amino]butyl}amino)-4-oxobutanoate
C[C@]12CCC(=O)C=C1CC[C@@H]3[C@@H]2[C@H](C[C@]4([C@H]3CC[C@@]4(C(=O)COC(=O)CCC(=O)NCCCCNc5ccc6c(c5)c(=O)[nH][nH]c6=O)O)C)O
InChI=1S/C37H48N4O9/c1-35-13-11-23(42)17-21(35)5-7-25-27-12-14-37(49,36(27,2)19-28(43)32(25)35)29(44)20-50-31(46)10-9-30(45)39-16-4-3-15-38-22-6-8-24-26(18-22)34(48)41-40-33(24)47/h6,8,17-18,25,27-28,32,38,43,49H,3-5,7,9-16,19-20H2,1-2H3,(H,39,45)(H,40,47)(H,41,48)/t25-,27-,28-,32+,35-,36-,37-/m0/s1
NCVNXZMHSDAIBY-YMHOGYMYSA-N
CSID:117773, http://www.chemspider.com/Chemical-Structure.117773.html (accessed 04:08, 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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