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Substance Name: Serpentine hydrogen tartrate
RN: 58782-36-8
InChIKey: DSBKFQYHOCFEJB-RXAPEJBRSA-N

Molecular Formula

  • C21-H21-N2-O3.C4-H5-O6

Molecular Weight

  • 498.4854
 
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Names and Synonyms

Results Name

  • Serpentine hydrogen tartrate

Synonyms

  • EINECS 261-441-4
  • Serpentine hydrogen tartrate

Systematic Names

  • 3,4,5,6,16,17-Hexadehydro-16-(methoxycarbonyl)-19alpha-methyloxayohimbanium, salt with (R-(R*,R*))-tartaric acid (1:1)
  • Butanedioic acid, 2,3-dihydroxy- (2R,3R)-, ion(1-), (19alpha)-3,4,5,6,16,17-hexadehydro-16-(methoxycarbonyl)-19-methyloxayohimbanium
  • Butanedioic acid, 2,3-dihydroxy-(R-(R*,R*))-, ion(1-), (19alpha)-3,4,5,6,16,17-hexadehydro-16-(methoxycarbonyl)-19-methyloxayohimbanium
  • Oxayohimbanium, 3,4,5,6,16,17-hexadehydro-16-(methoxycarbonyl)-19-methyl-, (19alpha)-, salt with (2R,3R)-2,3-dihydroxybutanedioic acid (1:1)
  • Oxayohimbanium, 3,4,5,6,16,17-hexadehydro-16-(methoxycarbonyl)-19-methyl-, (19alpha)-, salt with (R-(R*,R*))-2,3-dihydroxybutanedioic acid (1:1)

Registry Numbers

CAS Registry Number

  • 58782-36-8

Related Registry Number

  • 18786-24-8 (Parent)

System Generated Number

  • 0058782368

Molecular Formulas

Molecular Formula

  • C21-H21-N2-O3.C4-H5-O6

Molecular Formula Fragments

  • C21-H21-N2-O3
  • C4-H5-O6
  • COMPONENT

Structure Descriptors

InChI

1S/C21H20N2O3.C4H6O6/c1-12-16-10-23-8-7-14-13-5-3-4-6-18(13)22-20(14)19(23)9-15(16)17(11-26-12)21(24)25-2;5-1(3(7)8)2(6)4(9)10/h3-8,11-12,15-16H,9-10H2,1-2H3;1-2,5-6H,(H,7,8)(H,9,10)/t12-,15-,16+;/m0./s1

InChIKey

DSBKFQYHOCFEJB-RXAPEJBRSA-N

Smiles

[nH]1c2c(cccc2)c2c1c1[n+](cc2)C[C@H]2[C@H](C1)C(=CO[C@H]2C)C(=O)OC.C(=O)(C(C(C(=O)O)O)O)[O-]