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Substance Name: COMP regimen
ID: C037238000
InChIKey: OMFHQUCUWSMFOJ-FMONCPFKSA-N

Note

  • Chemotherapy protocol consisting of ... /Cyclophosphamide, Methotrexate, Prednisone, Vincristine/; see also record for COMP-1 in which prednisone is replaced by procarbazine; do not confuse with MCOP protocol.

Molecular Weight

  • 1898.9301
 
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Names and Synonyms

Results Name

  • COMP regimen

Name of Substance

  • COMP protocol

Synonyms

  • COMP
  • COMP regimen
  • Cyclophosphamide / Methotrexate /Prednisone / Vincristine regimen

Registry Number

  • C037238000

Structure Descriptors

InChI

1S/C46H56N4O10.C21H26O5.C20H22N8O5.C7H15Cl2N2O2P/c1-7-42(55)22-28-23-45(40(53)58-5,36-30(16-20-48(24-28)25-42)29-12-9-10-13-33(29)47-36)32-15-14-31-34(35(32)57-4)50(26-51)38-44(31)18-21-49-19-11-17-43(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;1-28(9-11-8-23-17-15(24-11)16(21)26-20(22)27-17)12-4-2-10(3-5-12)18(31)25-13(19(32)33)6-7-14(29)30;8-2-5-11(6-3-9)14(12)10-4-1-7-13-14/h9-15,17,26,28,37-39,47,55-56H,7-8,16,18-25H2,1-6H3;5,7,9,14-15,18,22,26H,3-4,6,8,10-11H2,1-2H3;2-5,8,13H,6-7,9H2,1H3,(H,25,31)(H,29,30)(H,32,33)(H4,21,22,23,26,27);1-7H2,(H,10,12)/t28-,37-,38+,39+,42-,43+,44+,45-,46-;14-,15-,18+,19-,20-,21-;13-;/m000./s1

InChIKey

OMFHQUCUWSMFOJ-FMONCPFKSA-N

Smiles

N12[C@H]3[C@@](C=CC1)([C@H]([C@]([C@H]1[C@@]3(c3c(N1C=O)c(c(cc3)[C@@]1(C3=[C@@H](c4c(N3)cccc4)CCN3C[C@@H](C[C@@](C3)(O)CC)C1)C(=O)OC)OC)CC2)(O)C(=O)OC)OC(=O)C)CC.[C@@H]12CC[C@]([C@]1(CC(=O)[C@@H]1[C@@]3(C(=CC(=O)C=C3)CC[C@@H]21)C)C)(O)C(=O)CO.N(CCCl)(P1(=O)OCCCN1)CCCl.N([C@H](C(=O)O)CCC(=O)O)C(=O)c1ccc(cc1)N(C)Cc1nc2c(nc1)nc(nc2N)N