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Chemical structure of Microcystin-LA

GC18859

Microcystin-LA

Also known as (5R,8S,11R,12S,15S,18S,19S,22R)-18-[(1E,3E,5S,6S)-6-methoxy-3,5-dimethyl-7-phenylhepta-1,3-dienyl]-1,5,12,15,19-pentamethyl-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

Microcystins are hepatotoxic cyclic heptapeptide toxins produced by cyanobacteria

ChemicalCAS96180-79-9MW910.1FormulaC46H67N7O12
CAS number
96180-79-9
Molecular weight
910.1
Formula
C46H67N7O12
Solubility
Ethanol： Soluble,Methanol： Soluble
InChIKey
DIAQQISRBBDJIM-DRSCAGMXSA-N
Catalogue number
GC18859
Brand
GLPBIO
Computed properties PubChem CID 6437382 · XLogP 3.5 · TPSA 279 Ų · H-bond donors 8
XLogP
3.5
TPSA
279 Ų
H-bond donors
8
H-bond acceptors
12
Rotatable bonds
11
Heavy atoms
65

SMILES C[C@H]1[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@@H](NC(=O)[C@@H](NC(=O)[C@H](NC(=O)C(=C)N(C(=O)CC[C@@H](NC1=O)C(=O)O)C)C)CC(C)C)C(=O)O)C)C)/C=C/C(=C/[C@H](C)[C@H](CC2=CC=CC=C2)OC)/C

Computed descriptors from PubChem (CID 6437382), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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