13C Labelled Fumonisins B1 and B2 Mixture 5 µg/mL in Acetonitrile/Water
Product Code
DRE-A30000009WL
CAS Number
2 AnalytesProduct Format
Mixture
Solvent
Water:Acetonitrile
Product Categories
Dr. Ehrenstorfer, Mycotoxin Reference Materials , Mycotoxin Research and Reference Materials , Mycotoxins
Product Type
Stable Isotope LabelledUnlabelled CAS Number
2 AnalytesDocumentation
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Product Information
Analyte Data
Analyte Name
Concentration
CAS Number
Molecular Structure
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Alternate CAS Number
Unlabelled CAS Number
Molecular Formula
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SMILES
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InChI
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IUPAC
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Fumonisin B1 (13C34)
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
Molecular Formula
13C34 H59 N O15
Molecular Weight
755.58
Accurate Mass
755.5025
SMILES
[13CH3][13CH2][13CH2][13CH2][13C@@H]([13CH3])[13C@@H](O[13C](=O)[13CH2][13C@@H]([13CH2][13C](=O)O)[13C](=O)O)[13C@H]([13CH2][13C@@H]([13CH3])[13CH2][13C@H](O)[13CH2][13CH2][13CH2][13CH2][13C@@H](O)[13CH2][13C@H](O)[13C@H]([13CH3])N)O[13C](=O)[13CH2][13C@@H]([13CH2][13C](=O)O)[13C](=O)O
InChI
InChI=1S/C34H59NO15/c1-5-6-9-20(3)32(50-31(44)17-23(34(47)48)15-29(41)42)27(49-30(43)16-22(33(45)46)14-28(39)40)13-19(2)12-24(36)10-7-8-11-25(37)18-26(38)21(4)35/h19-27,32,36-38H,5-18,35H2,1-4H3,(H,39,40)(H,41,42)(H,45,46)(H,47,48)/t19-,20+,21-,22+,23+,24+,25+,26-,27-,32+/m0/s1/i1+1,2+1,3+1,4+1,5+1,6+1,7+1,8+1,9+1,10+1,11+1,12+1,13+1,14+1,15+1,16+1,17+1,18+1,19+1,20+1,21+1,22+1,23+1,24+1,25+1,26+1,27+1,28+1,29+1,30+1,31+1,32+1,33+1,34+1
IUPAC
(2R)-2-[2-[(1S,3S,5R,10R,12S,13S)-13-amino-1-[(1R,2R)-1-[(3R)-3,4-bis(hydroxycarbonyl)(1,2,3,4-^{13}C_{4})butanoyl]oxy-2-(1^{13}C)methyl-(1,2,3,4,5,6-^{13}C_{6})hexyl]-5,10,12-trihydroxy-3-(1^{13}C)methyl-(1,2,3,4,5,6,7,8,9,10,11,12,13,14-^{13}C_{14})tetradecoxy]-2-oxo-(1,2-^{13}C_{2})ethyl](1,2,3,4-^{13}C_{4})butanedioic acid
Fumonisin B2 (U-13C34)
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
Molecular Formula
13C34 H59 N O14
Molecular Weight
739.58
Accurate Mass
739.5076
SMILES
[13CH3][13CH2][13CH2][13CH2][13C@@H]([13CH3])[13C@@H](O[13C](=O)[13CH2][13C@@H]([13CH2][13C](=O)O)[13C](=O)O)[13C@H]([13CH2][13C@@H]([13CH3])[13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13C@@H](O)[13CH2][13C@H](O)[13C@H]([13CH3])N)O[13C](=O)[13CH2][13C@@H]([13CH2][13C](=O)O)[13C](=O)O
InChI
InChI=1S/C34H59NO14/c1-5-6-12-21(3)32(49-31(43)18-24(34(46)47)16-29(40)41)27(48-30(42)17-23(33(44)45)15-28(38)39)14-20(2)11-9-7-8-10-13-25(36)19-26(37)22(4)35/h20-27,32,36-37H,5-19,35H2,1-4H3,(H,38,39)(H,40,41)(H,44,45)(H,46,47)/t20-,21+,22-,23+,24+,25+,26-,27-,32+/m0/s1/i1+1,2+1,3+1,4+1,5+1,6+1,7+1,8+1,9+1,10+1,11+1,12+1,13+1,14+1,15+1,16+1,17+1,18+1,19+1,20+1,21+1,22+1,23+1,24+1,25+1,26+1,27+1,28+1,29+1,30+1,31+1,32+1,33+1,34+1
IUPAC
(2R)-2-[2-[(1S,3S,10R,12S,13S)-13-amino-1-[(1R,2R)-1-[(3R)-3,4-bis(hydroxycarbonyl)(1,2,3,4-^{13}C_{4})butanoyl]oxy-2-(1^{13}C)methyl-(1,2,3,4,5,6-^{13}C_{6})hexyl]-10,12-dihydroxy-3-(1^{13}C)methyl-(1,2,3,4,5,6,7,8,9,10,11,12,13,14-^{13}C_{14})tetradecoxy]-2-oxo-(1,2-^{13}C_{2})ethyl](1,2,3,4-^{13}C_{4})butanedioic acid
Product Data
Storage Temperature
-20°C
Shipping Temperature
Ice pack (-20°C)
Country of Origin
AUSTRIA
Transport Restrictions
Air Excepted
Product Type
Stable Isotope Labelled
Product Format
Mixture
Solvent
Water:Acetonitrile
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