Name: Microcystin-LR Calibration Solution CRM
Brand: National Research Council of Canada (NRC)
SKU: NRC-CRM-MCLR

National Research Council of Canada (NRC)

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Product Overview

Product Code

NRC-CRM-MCLR

CAS Number

101043-37-2

Product Format

Single Solution

Matrix

Aqueous methanol

Molecular Formula

C49H74N10O12

Molecular Weight

995.19

Product Categories

Environmental Food Contaminant Reference Materials , National Research Council Canada (NRC-CNRC), Microbiology Reference Materials, Mycotoxin Research and Reference Materials , Mycotoxin Reference Materials

Documentation

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Product Information

Analyte Name

Microcystin LR

CAS Number

101043-37-2

Molecular Formula

C49H74N10O12

Molecular Weight

995.19

Measured Value

10.2 μmol/L

Accurate Mass

994.549

SMILES

CC1C(NC(=O)C(NC(=O)C(C(NC(=O)C(NC(=O)C(NC(=O)C(=C)N(C(=O)CCC(NC1=O)C(=O)O)C)C)CC(C)C)C(=O)O)C)CCCN=C(N)N)C=CC(=CC(C)C(CC2=CC=CC=C2)OC)C

InChI

InChI=1S/C49H74N10O12/c1-26(2)23-37-46(66)58-40(48(69)70)30(6)42(62)55-35(17-14-22-52-49(50)51)45(65)54-34(19-18-27(3)24-28(4)38(71-10)25-33-15-12-11-13-16-33)29(5)41(61)56-36(47(67)68)20-21-39(60)59(9)32(8)44(64)53-31(7)43(63)57-37/h11-13,15-16,18-19,24,26,28-31,34-38,40H,8,14,17,20-23,25H2,1-7,9-10H3,(H,53,64)(H,54,65)(H,55,62)(H,56,61)(H,57,63)(H,58,66)(H,67,68)(H,69,70)(H4,50,51,52)/b19-18+,27-24+/t28-,29-,30-,31+,34-,35-,36+,37-,38-,40+/m0/s1

IUPAC

(5R,8S,11R,12S,15S,18S,19S,22R)-15-[3-(diaminomethylideneamino)propyl]-18-[(1E,3E,5S,6S)-6-methoxy-3,5-dimethyl-7-phenylhepta-1,3-dienyl]-1,5,12,19-tetramethyl-2-methylidene-8-(2-methylpropyl)-3,6,9,13,16,20,25-heptaoxo-1,4,7,10,14,17,21-heptazacyclopentacosane-11,22-dicarboxylic acid

Storage Temperature

-20°C

Shipping Temperature

Ice pack (-20°C)

Country of Origin

CANADA

Product Format

Single Solution

Matrix

Aqueous methanol

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