1-Naphthalenesulfonic Acid, 5-((2-((((2-((((((17β)-17-Hydroxyandrost-4-En-3-Ylidene)Amino)Oxy)Acetyl)Amino)Ethyl)Thio)Acetyl)Amino)Ethyl)Amino)-

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Formula C37H50N4O7S2
IUPAC Name 5-[2-[[2-[2-[[2-[(z)-[(8r,9s,10r,13s,14r,17s)-17-hydroxy-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-ylidene]amino]oxyacetyl]amino]ethylsulfanyl]acetyl]amino]ethylamino]naphthalene-1-sulfonic acid
Molecular Mass 726.945 g·mol−1
Heat of Formation -1076.2 ± 16.7 kJ·mol−1
Dipole Moment 3.72 ± 1.08 D
Volume 876.83 Å 3
Surface Area 620.48 Å 2
HOMO Energy -8.61 ± 0.55 eV
LUMO Energy -1.20 ± eV
Point Group Symmetry C1
InChIKey WFWAMPNZDXTYTJ-CCPZTSEHSA-N
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