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Substance Name: Vinleurosine sulfate [USAN]
RN: 54081-68-4
UNII: G7E5NU015T
InChIKey: YCWXIQRLONXJLF-FOVAWKNMSA-N

Classification Code

  • Antineoplastic

Molecular Formula

  • C46-H56-N4-O9.1/2H2-O4-S

Molecular Weight

  • 1716.0126
 
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Names and Synonyms

Name of Substance

  • Vinleurosine sulfate [USAN]

Synonyms

  • 32645
  • Leurosine sulfate
  • Lilly 32645
  • NSC 90636
  • NSC-528004
  • NSC-90636
  • UNII-G7E5NU015T
  • Vinleurosine sulfate

Systematic Name

  • Vincaleukoblastine, 4'-deoxy-3',4'-epoxy-, (3'.alpha.,4'.alpha.)-, sulfate (2:1) (salt)

Registry Numbers

CAS Registry Number

  • 54081-68-4

FDA UNII

  • G7E5NU015T

Other Registry Numbers

  • 1404-95-1
  • 57986-74-0

System Generated Number

  • 0054081684

Molecular Formulas

Molecular Formula

  • C46-H56-N4-O9.1/2H2-O4-S

Molecular Formula Fragments

  • C46-H56-N4-O9
  • COMPONENT
  • H2-O4-S

Structure Descriptors

InChI

1S/2C46H56N4O9.H2O4S/c2*1-8-42-16-12-18-50-20-17-44(37(42)50)30-21-31(34(55-5)22-33(30)48(4)38(44)46(54,41(53)57-7)39(42)58-26(3)51)45(40(52)56-6)23-27-24-49(25-43(9-2)36(27)59-43)19-15-29-28-13-10-11-14-32(28)47-35(29)45;1-5(2,3)4/h2*10-14,16,21-22,27,36-39,47,54H,8-9,15,17-20,23-25H2,1-7H3;(H2,1,2,3,4)/t2*27-,36+,37-,38+,39+,42+,43-,44+,45-,46-;/m00./s1

InChIKey

YCWXIQRLONXJLF-FOVAWKNMSA-N

Smiles

CC[C@]12C[N@@]3CCc4c5ccccc5[nH]c4[C@](C[C@@H](C3)[C@H]1O2)(c6cc7c(cc6OC)N([C@@H]8[C@]79CCN1[C@H]9[C@@](C=CC1)([C@H]([C@@]8(C(=O)OC)O)OC(=O)C)CC)C)C(=O)OC.CC[C@]12C[N@@]3CCc4c5ccccc5[nH]c4[C@](C[C@@H](C3)[C@H]1O2)(c6cc7c(cc6OC)N([C@@H]8[C@]79CCN1[C@H]9[C@@](C=CC1)([C@H]([C@@]8(C(=O)OC)O)OC(=O)C)CC)C)C(=O)OC.OS(=O)(=O)O