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Substance Name: Rynatan
RN: 130463-94-4
InChIKey: KAWNXTJMGZPQTP-PVHVDDSLSA-N

Classification Code

  • Antihistaminic Decongestant

Molecular Formula

  • Unspecified

Molecular Weight

  • 5612.4006
 
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Names and Synonyms

Name of Substance

  • Rynatan

Systematic Name

  • Rynatan

Registry Numbers

CAS Registry Number

  • 130463-94-4

System Generated Number

  • 0130463944

Structure Descriptors

InChI

1S/2C76H52O46.5C16H19ClN2.5C9H13NO2/c2*77-32-1-22(2-33(78)53(32)92)67(103)113-47-16-27(11-42(87)58(47)97)66(102)112-21-52-63(119-72(108)28-12-43(88)59(98)48(17-28)114-68(104)23-3-34(79)54(93)35(80)4-23)64(120-73(109)29-13-44(89)60(99)49(18-29)115-69(105)24-5-36(81)55(94)37(82)6-24)65(121-74(110)30-14-45(90)61(100)50(19-30)116-70(106)25-7-38(83)56(95)39(84)8-25)76(118-52)122-75(111)31-15-46(91)62(101)51(20-31)117-71(107)26-9-40(85)57(96)41(86)10-26;5*1-19(2)12-10-15(16-5-3-4-11-18-16)13-6-8-14(17)9-7-13;5*1-10-6-9(12)7-3-2-4-8(11)5-7/h2*1-20,52,63-65,76-101H,21H2;5*3-9,11,15H,10,12H2,1-2H3;5*2-5,9-12H,6H2,1H3/t2*52-,63-,64+,65-,76?;;;;;;5*9-/m11.....00000/s1

InChIKey

KAWNXTJMGZPQTP-PVHVDDSLSA-N

Smiles

c1c(ccc(c1)C(CCN(C)C)c1ccccn1)Cl.c1([C@H](CNC)O)cccc(c1)O.O=C(c1cc(c(c(c1)OC(=O)c1cc(c(c(c1)O)O)O)O)O)OC[C@H]1OC(OC(=O)c2cc(c(c(c2)OC(=O)c2cc(c(c(c2)O)O)O)O)O)[C@H](OC(=O)c2cc(c(c(c2)OC(=O)c2cc(c(c(c2)O)O)O)O)O)[C@@H](OC(=O)c2cc(c(c(c2)OC(=O)c2cc(c(c(c2)O)O)O)O)O)[C@@H]1OC(=O)c1cc(c(c(c1)OC(=O)c1cc(c(c(c1)O)O)O)O)O.c1c(ccc(c1)C(CCN(C)C)c1ccccn1)Cl.c1c(ccc(c1)C(CCN(C)C)c1ccccn1)Cl.c1c(ccc(c1)C(CCN(C)C)c1ccccn1)Cl.c1c(ccc(c1)C(CCN(C)C)c1ccccn1)Cl.c1([C@H](CNC)O)cccc(c1)O.c1([C@H](CNC)O)cccc(c1)O.c1([C@H](CNC)O)cccc(c1)O.c1([C@H](CNC)O)cccc(c1)O.O=C(c1cc(c(c(c1)OC(=O)c1cc(c(c(c1)O)O)O)O)O)OC[C@H]1OC(OC(=O)c2cc(c(c(c2)OC(=O)c2cc(c(c(c2)O)O)O)O)O)[C@H](OC(=O)c2cc(c(c(c2)OC(=O)c2cc(c(c(c2)O)O)O)O)O)[C@@H](OC(=O)c2cc(c(c(c2)OC(=O)c2cc(c(c(c2)O)O)O)O)O)[C@@H]1OC(=O)c1cc(c(c(c1)OC(=O)c1cc(c(c(c1)O)O)O)O)O