3D-(6-ACYL) PHAD®

cas: 252042-59-4 — see every product listed under this CAS number, including other names

3D-(6-ACYL) PHAD® (CAS 252042-59-4) is a chemical reagent available from Chemat. Available pack sizes: 10MG, 25MG. Offered by: Sigma-Aldrich.

brandSigma-Aldrich
catalog number699855P-10MG
cas252042-59-4
size10MG
availability availability
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Available pack sizes

brand size price
Sigma-Aldrich 10MG 9830.00 Pln
Sigma-Aldrich 25MG 20200.00 Pln

properties

purityNo data
delivery time1-2 weeks (only if in stock, to check click on availability)
Structural formula: {0} (CAS {1})

[(2R,3S,4R,5R,6R)-2-(hydroxymethyl)-3-phosphonooxy-5-[[(3R)-3-tetradecanoyloxytetradecanoyl]amino]-6-[(2R,3S,4R,5R)-2,3,4-trihydroxy-6-oxo-5-[[(3R)-3-tetradecanoyloxytetradecanoyl]amino]hexoxy]oxan-4-yl] (3R)-3-tetradecanoyloxytetradecanoate (CAS 252042-59-4) is a chemical compound with the molecular formula C96H181N2O21P and a molecular weight of 1730.4 g/mol. IUPAC name: [(2R,3S,4R,5R,6R)-2-(hydroxymethyl)-3-phosphonooxy-5-[[(3R)-3-tetradecanoyloxytetradecanoyl]amino]-6-[(2R,3S,4R,5R)-2,3,4-trihydroxy-6-oxo-5-[[(3R)-3-tetradecanoyloxytetradecanoyl]amino]hexoxy]oxan-4-yl] (3R)-3-tetradecanoyloxytetradecanoate. InChIKey: UWZZPPFXKHHIMQ-QXFLKPNTSA-N.

Identity
Molecular formulaC96H181N2O21P
Molecular weight1730.4 g/mol
IUPAC name[(2R,3S,4R,5R,6R)-2-(hydroxymethyl)-3-phosphonooxy-5-[[(3R)-3-tetradecanoyloxytetradecanoyl]amino]-6-[(2R,3S,4R,5R)-2,3,4-trihydroxy-6-oxo-5-[[(3R)-3-tetradecanoyloxytetradecanoyl]amino]hexoxy]oxan-4-yl] (3R)-3-tetradecanoyloxytetradecanoate
InChIKeyUWZZPPFXKHHIMQ-QXFLKPNTSA-N
SMILESCCCCCCCCCCCCCC(=O)O[C@H](CCCCCCCCCCC)CC(=O)N[C@@H]1[C@H]([C@@H]([C@H](O[C@H]1OC[C@H]([C@H]([C@@H]([C@H](C=O)NC(=O)C[C@@H](CCCCCCCCCCC)OC(=O)CCCCCCCCCCCCC)O)O)O)CO)OP(=O)(O)O)OC(=O)C[C@@H](CCCCCCCCCCC)OC(=O)CCCCCCCCCCCCC

Computed by PubChem (NCBI)

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