(Q82904453)

English

3-({Hydroxy[(2,3,4,5,6-pentahydroxycyclohexyl)oxy]phosphoryl}oxy)propane-1,2-diyl ditetradecanoate

group of stereoisomers with the chemical formula C₃₇H₇₁O₁₃P

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instance of

group of stereoisomers

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subclass of

chemical compound

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mass

754.4632289619997 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₃₇H₇₁O₁₃P

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based on heuristic

inferred from SMILES

canonical SMILES

CCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OC1C(O)C(O)C(O)C(O)C1O)OC(=O)CCCCCCCCCCCCC

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based on heuristic

inferred from isomeric SMILES

isomeric SMILES

CCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OC1[C@@H](O)[C@H](O)C(O)[C@H](O)[C@@H]1O)OC(=O)CCCCCCCCCCCCC

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based on heuristic

inferred from InChI

Identifiers

InChI

InChI=1S/C37H71O13P/c1-3-5-7-9-11-13-15-17-19-21-23-25-30(38)47-27-29(49-31(39)26-24-22-20-18-16-14-12-10-8-6-4-2)28-48-51(45,46)50-37-35(43)33(41)32(40)34(42)36(37)44/h29,32-37,40-44H,3-28H2,1-2H3,(H,45,46)/t29?,32?,33-,34+,35-,36-,37?/m0/s1

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InChIKey

LYBDVVBIMGTZMB-HVIJGSDCSA-N

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1 reference

26 December 2021

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DSSTOX compound identifier

DTXCID201358254

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(Q82904453)

3-({Hydroxy[(2,3,4,5,6-pentahydroxycyclohexyl)oxy]phosphoryl}oxy)propane-1,2-diyl ditetradecanoate

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