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Substance Name: Nitrogen mustard regimen with prednisone, procarbazine and vincristine
RN: 113803-47-7
InChIKey: SVYBPMMLNVMOPS-WBQZPATFSA-N

Molecular Formula

  • C46-H56-N4-O10.C21-H26-O5.C12-H19-N3-O.C5-H11-Cl2-N.Cl-H

Molecular Weight

  • 1597.22
 
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Names and Synonyms

Name of Substance

  • MOPP protocol
  • Nitrogen mustard regimen with prednisone, procarbazine and vincristine

Synonyms

  • 22-Oxovincaleukoblastine mixt. with 2-chloro-N-(2-chloroethyl)-N-methylethanamine hydrochloride, 17,21-dihydroxypregna-1,4-diene-3,11,20-trione and N-(1-methylethyl)-4-((2-methylhydrazino)methyl)benzamide
  • MOPP
  • Nitrogen mustard / prednisone / procarbazine / vincristine
  • Vincristine - prednisone - nitrogen mustard - procarbazine mixt.
  • Vincristine-prednisone-nitrogen mustard-procarbazine mixt

Systematic Name

  • Vincaleukoblastine, 22-oxo-, mixt. with 2-chloro-N-(2-chloroethyl)-N-methylethanamine hydrochloride, 17,21-dihydroxypregna-1,4-diene-3,11,20-trione and N-(1-methylethyl)-4-((2-methylhydrazino)methyl)benzamide

Registry Numbers

CAS Registry Number

  • 113803-47-7

System Generated Number

  • 0113803477

Molecular Formulas

Molecular Formula

  • C46-H56-N4-O10.C21-H26-O5.C12-H19-N3-O.C5-H11-Cl2-N.Cl-H

Molecular Formula Fragments

  • C12-H19-N3-O
  • C21-H26-O5
  • C46-H56-N4-O10
  • C5-H11-Cl2-N
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C46H56N4O10.C21H26O5.C12H19N3O.C5H11Cl2N.ClH/c1-7-42(55)22-28-23-45(40(53)58-5,36-30(14-18-48(24-28)25-42)29-12-9-10-13-33(29)47-36)32-20-31-34(21-35(32)57-4)50(26-51)38-44(31)16-19-49-17-11-15-43(8-2,37(44)49)39(60-27(3)52)46(38,56)41(54)59-6;1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19;1-9(2)15-12(16)11-6-4-10(5-7-11)8-14-13-3;1-8(4-2-6)5-3-7;/h9-13,15,20-21,26,28,37-39,47,55-56H,7-8,14,16-19,22-25H2,1-6H3;5,7,9,14-15,18,22,26H,3-4,6,8,10-11H2,1-2H3;4-7,9,13-14H,8H2,1-3H3,(H,15,16);2-5H2,1H3;1H/t28-,37?,38?,39-,42+,43-,44-,45+,46+;14-,15-,18+,19-,20-,21-;;;/m10.../s1

InChIKey

SVYBPMMLNVMOPS-WBQZPATFSA-N

Smiles

c12[C@]34[C@@H]5[C@@]([C@H]([C@@]([C@@H]3N(c1cc(OC)c(c2)[C@@]1(c2c(c3ccccc3[nH]2)CC[N@]2C[C@@H](C1)C[C@](CC)(O)C2)C(OC)=O)C=O)(C(OC)=O)O)OC(C)=O)(C=CC[N@@]5CC4)CC.C1[C@H]2[C@H]3[C@@]([C@](C(CO)=O)(O)CC3)(CC([C@@H]2[C@@]2(C(=CC(=O)C=C2)C1)C)=O)C.c1(ccc(CNNC)cc1)C(NC(C)C)=O.N(CCCl)(CCCl)C.Cl