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Substance Name: Ganglioside GM3 lactone
RN: 99477-47-1
InChIKey: BCXFBIAHUWAIAL-MMXMALAYSA-N

Molecular Formula

  • C61-H108-N2-O20

Molecular Weight

  • 1189.52
 
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Names and Synonyms

Name of Substance

  • Ganglioside GM3 lactone

Synonyms

  • G(M3) Ganglioside lactone
  • GM(3)-Ganglioside lactone
  • GM3-Lactone

Systematic Name

  • 9-Octadecenamide, N-(1-(((O-(N-acetyl-alpha-nuraminosyl)-(2-3)-O-1',2-anhydro-beta-D-galactopyranosyl-(1-4)-beta-D-glucopyranosyl)oxy)methyl)-2-hydroxy-3-nonadecyl)-, (R-(R*,S*-(E,Z)))-

Registry Numbers

CAS Registry Number

  • 99477-47-1

System Generated Number

  • 0099477471

Structure Descriptors

InChI

1S/C61H108N2O20/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-43(68)42(63-48(71)35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-5-2)40-77-58-53(75)52(74)54(47(39-66)79-58)80-59-57-56(51(73)46(38-65)78-59)83-61(60(76)81-57)36-44(69)49(62-41(3)67)55(82-61)50(72)45(70)37-64/h19,21,32,34,42-47,49-59,64-66,68-70,72-75H,4-18,20,22-31,33,35-40H2,1-3H3,(H,62,67)(H,63,71)/b21-19+,34-32+

InChIKey

BCXFBIAHUWAIAL-MMXMALAYSA-N

Smiles

CCCCCCCC\C=C\CCCCCCCC(N[C@@H](CO[C@@H]1[C@@H]([C@@H]([C@@H](O[C@@H]2O[C@@H](CO)[C@@H]([C@@H]3[C@@H]2OC([C@@]2(O3)C[C@@H](O)[C@@H](NC(C)=O)[C@@H]([C@@H]([C@@H](CO)O)O)O2)=O)O)[C@@H](O1)CO)O)O)[C@@H](O)\C=C\CCCCCCCCCCCCCCC)=O