N-Hexanoyl-biotin-disialoganglioside GD3 (ammonium salt)
Synonyms:
C6 Biotin Ganglioside GD3 (d18:1/6:0) (ammonium salt), Biotin-C6:0-GD3
Identifiers
CAS Index Name:
(3aS,4S,6aR)-N-[6-[[(1S,2R,3E)-1-[[[O-(N-acetyl-α-neuraminosyl)-(2→8)-O-(N-acetyl-α-neuraminosyl)-(2→3)-O-β-D-galactopyranosyl-(1→4)-β-D-glucopyranosyl]oxy]methyl]-2-hydroxy-3-heptadecen-1-yl]amino]-6-oxohexyl]hexahydro-2-oxo-1H-thieno[3,4-d]imidazole-4-pentanamide, diammonium salt
Molecular formula:
C68H114N6O31S.2NH4
Molecular weight:
1579.8
Smiles:
OC[C@H]1O[C@@H](OC[C@H](NC(CCCCCNC(CCCC[C@@H]2SC[C@@](N3)([H])[C@]2([H])NC3=O)=O)=O)[C@H](O)/C=C/CCCCCCCCCCCCC)[C@H](O)[C@@H](O)[C@@H]1O[C@]4([H])O[C@H](CO)[C@H](O)[C@H](O[C@@]5(C([O-])=O)O[C@]([C@H](O)[C@H](O[C@@]6(C([O-])=O)O[C@]([C@H](O)[C@@H](CO)O)([H])[C@H](NC(C)=O)[C@@H](O)C6)CO)([H])[C@H](NC(C)=O)[C@@H](O)C5)[C@H]4O.[NH4+].[NH4+]
InChI:
InChI=1S/C68H116N6O31S.2H3N/c1-4-5-6-7-8-9-10-11-12-13-14-15-17-22-39(81)37(72-48(86)25-18-16-21-26-69-47(85)24-20-19-23-46-49-38(34-106-46)73-66(97)74-49)33-98-62-56(91)55(90)58(45(32-78)100-62)101-63-57(92)61(53(88)43(30-76)99-63)105-68(65(95)96)28-41(83)51(71-36(3)80)60(104-68)54(89)44(31-77)102-67(64(93)94)27-40(82)50(70-35(2)79)59(103-67)52(87)42(84)29-75;;/h17,22,37-46,49-63,75-78,81-84,87-92H,4-16,18-21,23-34H2,1-3H3,(H,69,85)(H,70,79)(H,71,80)(H,72,86)(H,93,94)(H,95,96)(H2,73,74,97);2*1H3/b22-17+;;/t37-,38-,39+,40-,41-,42+,43+,44+,45+,46-,49-,50+,51+,52+,53-,54+,55+,56+,57+,58+,59+,60+,61-,62+,63-,67+,68-;;/m0../s1
InChIKey:
KFUBGJNVFNGFIJ-FIOUALRJSA-N
Product information
Purity:
>98%
Storage:
Freezer
Supplied as:
Neat
Physical state:
Solid
Documentation:
Certificate of Analysis
MSDS:
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| 39-4003-45 | N-Hexanoyl-biotin-disialoganglioside GD3 (ammonium salt) - 500 ug | Neat | 1,007.00 € |
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