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Substance Name: Monocrotaline methiodide
RN: 14551-24-7
UNII: NQO2T02IDT
InChIKey: FXDAWNITMWEFJA-HQWALNEFSA-M

Molecular Weight

  • 467.2934
 
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Names and Synonyms

Name of Substance

  • Monocrotaline methiodide

Synonyms

  • 20-Norcrotalananium, 14,19-dihydro-12,13-dihydroxy-4-methyl-11,15-dioxo-, iodide, (13alpha,14alpha)-
  • Monocrotaline methiodide
  • Monocrotaline methiodide [MI]
  • UNII-NQO2T02IDT

Registry Numbers

CAS Registry Number

  • 14551-24-7

FDA UNII

  • NQO2T02IDT

System Generated Number

  • 0014551247

Structure Descriptors

InChI

1S/C17H26NO6.HI/c1-10-14(19)24-12-6-8-18(4)7-5-11(13(12)18)9-23-15(20)17(3,22)16(10,2)21;/h5,10,12-13,21-22H,6-9H2,1-4H3;1H/q+1;/p-1/t10-,12+,13+,16+,17-,18?;/m0./s1

InChIKey

FXDAWNITMWEFJA-HQWALNEFSA-M

Smiles

C[C@H]1C(=O)O[C@@H]2CC[N+]3([C@@H]2C(=CC3)COC(=O)[C@]([C@]1(C)O)(C)O)C.[I-]