Products 1246304-68-6

CAS 1246304-68-6 is the registry number for 17:0-20:4 pi(4)P. Offered by: Sigma-Aldrich. Available pack sizes: 1EA.

17:0-20:4 pi(4)P
Sigma-Aldrich
  • size: 1EA
  • Variants: 1
from 1910.00
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Structural formula: {0} (CAS {1})

Diazanium;[(2R,3R,5R,6S)-4-[[(2R)-3-heptadecanoyloxy-2-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyl]oxypropoxy]-oxidophosphoryl]oxy-2,3,5,6-tetrahydroxycyclohexyl] hydrogen phosphate (CAS 1246304-68-6) is a chemical compound with the molecular formula C46H88N2O16P2 and a molecular weight of 987.1 g/mol. IUPAC name: diazanium;[(2R,3R,5R,6S)-4-[[(2R)-3-heptadecanoyloxy-2-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyl]oxypropoxy]-oxidophosphoryl]oxy-2,3,5,6-tetrahydroxycyclohexyl] hydrogen phosphate. InChIKey: PAUDLJVALNTADC-XQWDNFFDSA-N.

Identity
Molecular formulaC46H88N2O16P2
Molecular weight987.1 g/mol
IUPAC namediazanium;[(2R,3R,5R,6S)-4-[[(2R)-3-heptadecanoyloxy-2-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyl]oxypropoxy]-oxidophosphoryl]oxy-2,3,5,6-tetrahydroxycyclohexyl] hydrogen phosphate
InChIKeyPAUDLJVALNTADC-XQWDNFFDSA-N
SMILESCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OC1[C@@H]([C@H](C([C@H]([C@H]1O)O)OP(=O)(O)[O-])O)O)OC(=O)CCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC.[NH4+].[NH4+]

Computed by PubChem (NCBI)

Isomers (same molecular formula)
diazanium;[(1R,2R,3S,4R,5S,6S)-3-[[(2R)-3-heptadecanoyloxy-2-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyl]oxypropoxy]-oxidophosphoryl]oxy-2,4,5,6-tetrahydroxycyclohexyl] hydrogen phosphate C46H88N2O16P2
diazanium;[(1S,2R,3R,4R,5R,6R)-3-[[(2R)-3-heptadecanoyloxy-2-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyl]oxypropoxy]-oxidophosphoryl]oxy-2,4,5,6-tetrahydroxycyclohexyl] hydrogen phosphate C46H88N2O16P2