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Cyclo[2,3-didehydro-N-methylalanyl-D-alanyl-L-leucyl-(3S)-3-methyl-D-b-aspartyl-L-arginyl-(2S,3S,4E,6E,8S,9S)-3-amino-9-methoxy-2,6,8-trimethyl-10-phenyl-4,6-decadienoyl-D-g-glutamyl] (101043-37-2)

Identification
Name:Cyclo[2,3-didehydro-N-methylalanyl-D-alanyl-L-leucyl-(3S)-3-methyl-D-b-aspartyl-L-arginyl-(2S,3S,4E,6E,8S,9S)-3-amino-9-methoxy-2,6,8-trimethyl-10-phenyl-4,6-decadienoyl-D-g-glutamyl]
Synonyms:MicrocystinLA, 5-L-arginine-; Microcystin LR (9CI);1,4,7,10,14,17,21-Heptaazacyclopentacosane, cyclic peptide deriv.; Akerstox;Cyanoginosin LA, 5-L-arginine-; Cyanoginosin LR; Cyclo[2,3-didehydro-N-methylalanyl-D-alanyl-L-leucyl-erythro-3-methyl-D-b-aspartyl-L-arginyl-(2S,3S,4E,6E,8S,9S)-4,5,6,7-tetradehydro-9-methoxy-2,6,8-trimethyl-10-phenyl-3-aminodecanoyl-D-g-glutamyl]; MCLR; MCYST-LR; ToxinI (Microcystis aeruginosa); Toxin T 17 (Microcystis aeruginosa)
CAS:101043-37-2
EINECS: 200-659-6
Molecular Formula: C49H74 N10 O12
Molecular Weight: 995.33
InChI: InChI=1/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
Molecular Structure: (C49H74N10O12) MicrocystinLA, 5-L-arginine-; Microcystin LR (9CI);1,4,7,10,14,17,21-Heptaazacyclopentacosane, cycli...
Properties
Transport:UN 2811 6.1/PG 1
Flash Point: °C
Boiling Point: °Cat760mmHg
Density:1.29g/cm3
Refractive index:1.598
Solubility:1 mg/mL in ethanol
Flash Point: °C
Storage Temperature: −20°C
Color: White solid
Safety Data
 

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