Malacidin B

cas: 2254483-96-8 — see every product listed under this CAS number, including other names

Malacidin B (CAS 2254483-96-8) is a chemical reagent available from Chemat. Available pack sizes: Get quote. Offered by: MedChemExpress.

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catalog numberHY-N10585-Get quote
cas2254483-96-8
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Structural formula: {0} (CAS {1})

Malacidin B is a homodetic cyclic peptide that is malacidin A in which the (2E,4Z)-8-methylnona-2,4-dienoyl group has been replaced by a (2E,4Z)-8-methyldeca-2,4-dienoyl group. It has a role as a member of calcium-dependent antibiotics, an antibacterial agent and a bacterial metabolite. It is a homodetic cyclic peptide and a lipopeptide.

Source: ChEBI

Identity
Molecular formulaC57H90N12O20
Molecular weight1263.4 g/mol
IUPAC name(3S)-4-[[(3S,6R,12S,15S,18S,21R,24S,28S,30R)-18-(4-aminobutyl)-6-(1-carboxyethyl)-15-[carboxy(hydroxy)methyl]-12-(carboxymethyl)-25,30-dimethyl-2,5,8,11,14,17,20,23,27-nonaoxo-3,21-di(propan-2-yl)-1,4,7,10,13,16,19,22,26-nonazabicyclo[26.3.0]hentriacontan-24-yl]amino]-2-methyl-3-[[(2E,4Z)-8-methyldeca-2,4-dienoyl]amino]-4-oxobutanoic acid
InChIKeySMTCDPMWINUUKC-AVBBYWJWSA-N
SMILESCCC(C)CC/C=C\C=C\C(=O)N[C@@H](C(C)C(=O)O)C(=O)N[C@H]1C(NC(=O)[C@@H]2C[C@H](CN2C(=O)[C@@H](NC(=O)[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](NC1=O)C(C)C)CCCCN)C(C(=O)O)O)CC(=O)O)C(C)C(=O)O)C(C)C)C)C

Computed by PubChem (NCBI)

Synonyms: Malacidin B

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