1,2-dipalmitoylglycero-3-phospho-(1'-D-myo-inositol-3'-phosphate) (Q27156484)

CHEBI:82948 (English)

9 October 2016

chemical formula

C₄₁H₈₀O₁₆P₂

1 reference

CHEBI:82948 (English)

9 October 2016

canonical SMILES

CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OC1C(C(C(C(C1O)OP(=O)(O)O)O)O)O)OC(=O)CCCCCCCCCCCCCCC

1 reference

CHEBI:82948 (English)

9 October 2016

isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H]([C@H]1O)OP(=O)(O)O)O)O)O)OC(=O)CCCCCCCCCCCCCCC

1 reference

CHEBI:82948 (English)

InChI=1S/C41H80O16P2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-34(42)53-31-33(55-35(43)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2)32-54-59(51,52)57-41-38(46)36(44)37(45)40(39(41)47)56-58(48,49)50/h33,36-41,44-47H,3-32H2,1-2H3,(H,51,52)(H2,48,49,50)/t33?,36-,37-,38+,39+,40+,41-/m0/s1

9 October 2016

Identifiers

InChI

1 reference

CHEBI:82948 (English)

SZPQTEWIRPXBTC-ABBDTXMNSA-N

9 October 2016

InChIKey

2 references

CHEBI:82948 (English)

9 October 2016

stated in

ChEBI release 2020-09-01

1 reference

3-[(Hydroxy{[(1S,2R,3S,4S,5R,6R)-2,3,4,6-tetrahydroxy-5-(phosphonooxy)cyclohexyl]oxy}phosphoryl)oxy]-1,2-propanediyl dihexadecanoate (English)

9 October 2016

2 references

CHEBI:82948 (English)

matched by identifier from

9 October 2016

InChIKey

SZPQTEWIRPXBTC-ABBDTXMNSA-N

ChEBI ID

82948

mapping relation type

2 references

1,2-dipalmitoylglycero-3-phospho-(1'-D-myo-inositol-3'-phosphate) (English)