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Substance Name: Cyanocobalamin mixture with folic acid and pyridoxine hydrochloride
RN: 454422-75-4
InChIKey: UDTYWYQIYYTEGL-LPFGWAPRSA-N

Molecular Weight

  • 2005.4448
 
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Names and Synonyms

Results Name

  • Cyanocobalamin mixture with folic acid and pyridoxine hydrochloride

Synonyms

  • Cyanocobalamin / folic acid / pyridoxine
  • Cyanocobalamin mixture with folic acid and pyridoxine
  • Cyanocobalamin mixture with folic acid and pyridoxine hydrochloride
  • Folacin, Vitamin B6 and Vitamin B12
  • Folate mixture with Pyridoxine and Vitamin B 12
  • Folbic
  • FOLTX

Registry Numbers

CAS Registry Number

  • 454422-75-4

System Generated Number

  • 0454422754

Structure Descriptors

InChI

1S/C62H90N13O14P.C19H19N7O6.C8H11NO3.CN.ClH.Co/c1-29-20-39-40(21-30(29)2)75(28-70-39)57-52(84)53(41(27-76)87-57)89-90(85,86)88-31(3)26-69-49(83)18-19-59(8)37(22-46(66)80)56-62(11)61(10,25-48(68)82)36(14-17-45(65)79)51(74-62)33(5)55-60(9,24-47(67)81)34(12-15-43(63)77)38(71-55)23-42-58(6,7)35(13-16-44(64)78)50(72-42)32(4)54(59)73-56;20-19-25-15-14(17(30)26-19)23-11(8-22-15)7-21-10-3-1-9(2-4-10)16(29)24-12(18(31)32)5-6-13(27)28;1-5-8(12)7(4-11)6(3-10)2-9-5;1-2;;/h20-21,23,28,31,34-37,41,52-53,56-57,73,76,84H,12-19,22,24-27H2,1-11H3,(H2,63,77)(H2,64,78)(H2,65,79)(H2,66,80)(H2,67,81)(H2,68,82)(H,69,83)(H,85,86);1-4,8,12,21H,5-7H2,(H,24,29)(H,27,28)(H,31,32)(H3,20,22,25,26,30);2,10-12H,3-4H2,1H3;;1H;/q;;;;;+1/b42-23-,54-32-,55-33-;;;;;/t31-,34+,35+,36+,37-,41+,52+,53+,56?,57-,59+,60-,61-,62-;12-;;;;/m00..../s1

InChIKey

UDTYWYQIYYTEGL-LPFGWAPRSA-N

Smiles

n1([C@@H]2[C@@H]([C@@H]([C@H](O2)CO)OP(=O)(O[C@H](CNC(=O)CC[C@]2(C3=C(C4=NC(=CC5=NC(=C(C6=N[C@]([C@]([C@@H]6CCC(=O)N)(CC(=O)N)C)(C(N3)[C@@H]2CC(=O)N)C)C)[C@]([C@@H]5CCC(=O)N)(CC(=O)N)C)C([C@@H]4CCC(=O)N)(C)C)C)C)C)O)O)c2c([n](c1)[Co+]C#N)cc(c(c2)C)C.n1c(=O)c2c([nH]c1N)ncc(n2)CNc1ccc(C(=O)N[C@H](C(=O)O)CCC(=O)O)cc1.c1(c(c(ncc1CO)C)O)CO.Cl