Tardomyocel Compound
[CAS# 137915-10-7]

Identification

• Name: Tardomyocel Compound
• Molecular Formula: C₁₁₉H₁₈₂N₂₄O₅₀S₆
• Molecular Weight: 2941.24
• CAS Registry Number: 137915-10-7
• SMILES: [S](O)(O)(=O)=O.O([C@@H]1O[C@H]([C@@](O)([C@H]1O[C@@H]2O[C@H]([C@H](O)[C@@H](O)[C@@H]2NC)CO)CO)C)[C@@H]3[C@@H](N=C(N)N)[C@H](O)[C@@H](N=C(N)N)[C@H](O)[C@H]3O.O([C@@H]4O[C@H]([C@@](O)([C@H]4O[C@@H]5O[C@H]([C@H](O)[C@@H](O)[C@@H]5NC)CO)CO)C)[C@@H]6[C@@H](N=C(N)N)[C@H](O)[C@@H](N=C(N)N)[C@H](O)[C@H]6O.O(CCN(CC)CC)C(=O)C7=CC=C(N)C=C7.N(CCNCC8=CC=CC=C8)CC9=CC=CC=C9.[C@H]%10%11SC([C@@H](N%10C(=O)[C@H]%11NC(=O)CC%12=CC=CC=C%12)C(O)=O)(C)C.[C@H]%13%14SC([C@@H](N%13C(=O)[C@H]%14NC(=O)CC%15=CC=CC=C%15)C(O)=O)(C)C.[C@H]%16%17SC([C@@H](N%16C(=O)[C@H]%17NC(=O)CC%18=CC=CC=C%18)C(O)=O)(C)C.O=[S](O)(O)=O.O=[S](O)(O)=O
• InChI: 1S/2C21H41N7O12.3C16H18N2O4S.C16H20N2.C13H20N2O2.3H2O4S/c2*1-5-21(36,4-30)16(40-17-9(26-2)13(34)10(31)6(3-29)38-17)18(37-5)39-15-8(28-20(24)25)11(32)7(27-19(22)23)12(33)14(15)35;3*1-16(2)12(15(21)22)18-13(20)11(14(18)23-16)17-10(19)8-9-6-4-3-5-7-9;1-3-7-15(8-4-1)13-17-11-12-18-14-16-9-5-2-6-10-16;1-3-15(4-2)9-10-17-13(16)11-5-7-12(14)8-6-11;3*1-5(2,3)4/h2*5-18,26,29-36H,3-4H2,1-2H3,(H4,22,23,27)(H4,24,25,28);3*3-7,11-12,14H,8H2,1-2H3,(H,17,19)(H,21,22);1-10,17-18H,11-14H2;5-8H,3-4,9-10,14H2,1-2H3;3*(H2,1,2,3,4)/t2*5-,6-,7+,8-,9-,10-,11+,12-,13-,14+,15+,16-,17-,18-,21+;3*11-,12+,14-;;;;;/m00111...../s1
• InChIKey: PRMBINSZWVHEGI-LBIWGONOSA-N