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Substance Name: Aricine oxalate
RN: 68135-10-4
UNII: 04BAC87S7F
InChIKey: PAUMEXDEFPNOBG-WUXOJFDOSA-N

Molecular Formula

  • C22-H26-N2-O4.C2-H2-O4

Molecular Weight

  • 472.4912
 
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Names and Synonyms

Name of Substance

  • Aricine oxalate

Synonyms

  • Aricine oxalate
  • Cinchovatine oxalate
  • Heterophylline oxalate
  • Oxayohimban-16-carboxylic acid, 16,17-didehydro-10-methoxy-19-methyl-, methyl ester, (19alpha,20alpha)-, ethanedioate (1:1)
  • Quinovatine oxalate
  • UNII-04BAC87S7F

Registry Numbers

CAS Registry Number

  • 68135-10-4

FDA UNII

  • 04BAC87S7F

System Generated Number

  • 0068135104

Structure Descriptors

InChI

1S/C22H26N2O4.C2H2O4/c1-12-17-10-24-7-6-14-16-8-13(26-2)4-5-19(16)23-21(14)20(24)9-15(17)18(11-28-12)22(25)27-3;3-1(4)2(5)6/h4-5,8,11-12,15,17,20,23H,6-7,9-10H2,1-3H3;(H,3,4)(H,5,6)/t12-,15-,17-,20-;/m0./s1

InChIKey

PAUMEXDEFPNOBG-WUXOJFDOSA-N

Smiles

COC(=O)C1=CO[C@@H](C)[C@@H]2CN3CCc4c([nH]c5ccc(OC)cc45)[C@@H]3C[C@H]12.OC(=O)C(=O)O