Products 1246304-71-1

CAS 1246304-71-1 is the registry number for 17:0-20:4 pi(3 5)P2. Offered by: Sigma-Aldrich. Available pack sizes: 1EA.

17:0-20:4 pi(3 5)P2
Sigma-Aldrich
  • size: 1EA
  • Variants: 1
from 1910.00
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Structural formula: {0} (CAS {1})

Triazanium;[(1S,2R,4R,5R)-3-[[(2R)-3-heptadecanoyloxy-2-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyl]oxypropoxy]-oxidophosphoryl]oxy-2,4,6-trihydroxy-5-[hydroxy(oxido)phosphoryl]oxycyclohexyl] hydrogen phosphate (CAS 1246304-71-1) is a chemical compound with the molecular formula C46H92N3O19P3 and a molecular weight of 1084.2 g/mol. IUPAC name: triazanium;[(1S,2R,4R,5R)-3-[[(2R)-3-heptadecanoyloxy-2-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyl]oxypropoxy]-oxidophosphoryl]oxy-2,4,6-trihydroxy-5-[hydroxy(oxido)phosphoryl]oxycyclohexyl] hydrogen phosphate. InChIKey: HTHVVOQZWMVYGD-QCCDWHMVSA-N.

Identity
Molecular formulaC46H92N3O19P3
Molecular weight1084.2 g/mol
IUPAC nametriazanium;[(1S,2R,4R,5R)-3-[[(2R)-3-heptadecanoyloxy-2-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyl]oxypropoxy]-oxidophosphoryl]oxy-2,4,6-trihydroxy-5-[hydroxy(oxido)phosphoryl]oxycyclohexyl] hydrogen phosphate
InChIKeyHTHVVOQZWMVYGD-QCCDWHMVSA-N
SMILESCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OC1[C@@H]([C@H](C([C@H]([C@H]1O)OP(=O)(O)[O-])O)OP(=O)(O)[O-])O)OC(=O)CCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC.[NH4+].[NH4+].[NH4+]

Computed by PubChem (NCBI)

Isomers (same molecular formula)
triazanium;[(1S,2S,3S,4R,5R,6S)-3-[[(2R)-3-heptadecanoyloxy-2-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyl]oxypropoxy]-oxidophosphoryl]oxy-2,4,5-trihydroxy-6-[hydroxy(oxido)phosphoryl]oxycyclohexyl] hydrogen phosphate C46H92N3O19P3
triazanium;[(1R,2S,3R,4R,5S,6R)-3-[[(2R)-3-heptadecanoyloxy-2-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyl]oxypropoxy]-oxidophosphoryl]oxy-2,4,5-trihydroxy-6-[hydroxy(oxido)phosphoryl]oxycyclohexyl] hydrogen phosphate C46H92N3O19P3