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Eravacycline dihydrochloride, TRC

Product Code. 30386891
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25 mg
Unit Size:
25mg
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Product Code. 30386891 Supplier Toronto Research Chemicals Supplier No. TRCE59400025MG

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Specifications

Chemical Name or Material Eravacycline dihydrochloride
CAS 1334714-66-7
Molecular Formula C27 H31 F N4 O8 . 2 Cl H
Quantity 25 mg
Synonym TP 434-046, TP-434 dihydrochloride
InChI Formula InChI=1S/C27H31FN4O8.2ClH/c1-31(2)20-13-8-11-7-12-14(28)9-15(30-16(33)10-32-5-3-4-6-32)21(34)18(12)22(35)17(11)24(37)27(13,40)25(38)19(23(20)36)26(29)39;;/h9,11,13,20,34-35,38,40H,3-8,10H2,1-2H3,(H2,29,39)(H,30,33);2*1H/t11-,13-,20-,27-;;/m0../s1
SMILES CN(C)[C@H]1[C@@H]2C[C@@H]3CC4=C(C=C(C(=C4C(=C3C(=O)[C@@]2(C(=C(C1=O)C(=O)N)O)O)O)O)NC(=O)CN5CCCC5)F.Cl.Cl
IUPAC Name (4S,4aS,5aR,12aR)-4-(dimethylamino)-7-fluoro-1,10,11,12a-tetrahydroxy-3,12-dioxo-9-(2-(pyrrolidin-1-yl)acetamido)-3,4,4a,5,5a,6,12,12a-octahydrotetracene-2-carboxamide dihydrochloride
Molecular Weight (g/mol) 631.48
Formula Weight 630.17
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