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

CAS Registry Number®

113803-47-7
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CAS Name

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

Molecular Formula

C46H56N4O10.C21H26O5.C12H19N3O.C5H11Cl2N.ClH

Cite this Page

Vincaleukoblastine, 22-oxo-, mixt. with 2-chloro-N-(2-chloroethyl)-N-methylethanamine hydrochloride (1:1), 17,21-dihydroxypregna-1,4-diene-3,11,20-trione and N-(1-methylethyl)-4-[(2-methylhydrazino)methyl]benzamide.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?ref=113803-47-7 (retrieved 2024-05-03) (CAS RN: 113803-47-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

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-;;;/m00.../s1

InChIKey

InChIKey=SVYBPMMLNVMOPS-GMOQXPGDSA-N

SMILES

C(NC(C)C)(=O)C1=CC=C(CNNC)C=C1.C(C)[C@@]12[C@]3([C@@]4([C@]([C@](C(OC)=O)(O)[C@@H]1OC(C)=O)(N(C=O)C=5C4=CC(=C(OC)C5)[C@]6(C(OC)=O)C7=C(C=8C(N7)=CC=CC8)CC[N@@]9C[C@](C6)(C[C@](CC)(O)C9)[H])[H])CCN3CC=C2)[H].N(CCCl)(CCCl)C.Cl.C[C@@]12[C@]([C@]3([C@@]([C@]4(C)C(CC3)=CC(=O)C=C4)(C(=O)C1)[H])[H])(CC[C@@]2(C(CO)=O)O)[H]

Canonical SMILES

Cl.O=CN1C2=CC(OC)=C(C=C2C34CCN5CC=CC(CC)(C(OC(=O)C)C(O)(C(=O)OC)C13)C54)C6(C(=O)OC)C=7NC=8C=CC=CC8C7CCN9CC(C6)CC(O)(C9)CC.O=C1C=CC2(C(=C1)CCC3C2C(=O)CC4(C)C3CCC4(O)C(=O)CO)C.O=C(NC(C)C)C1=CC=C(C=C1)CNNC.ClCCN(C)CCCl

Other Names for this Substance

  • Vincaleukoblastine, 22-oxo-, mixt. with 2-chloro-N-(2-chloroethyl)-N-methylethanamine hydrochloride (1:1), 17,21-dihydroxypregna-1,4-diene-3,11,20-trione and N-(1-methylethyl)-4-[(2-methylhydrazino)methyl]benzamide
  • 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
  • Vincristine-prednisone-nitrogen mustard-procarbazine mixt.
  • MOPP
  • MOPP (anticancer drug)

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