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2-(1,2-Distearoyl-3-rac-glycero)-5-benzyloxy-1,3,2-dioxaphosphorinane

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2-(1,2-Distearoyl-3-rac-glycero)-5-benzyloxy-1,3,2-dioxaphosphorinane
SpectraBase Compound ID 8pEAd5GxiAQ
InChI InChI=1S/C49H87O8P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-34-38-48(50)53-41-47(44-56-58-54-42-46(43-55-58)52-40-45-36-32-31-33-37-45)57-49(51)39-35-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h31-33,36-37,46-47H,3-30,34-35,38-44H2,1-2H3
InChIKey VODQRJVOWZRKST-UHFFFAOYSA-N
Mol Weight 835.2 g/mol
Molecular Formula C49H87O8P
Exact Mass 834.613857 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DZLZ4aCqkbj
Name 2-(1,2-Distearoyl-3-rac-glycero)-5-benzyloxy-1,3,2-dioxaphosphorinane
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 834.613856751 u
Formula C49H87O8P
InChI InChI=1S/C49H87O8P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-34-38-48(50)53-41-47(44-56-58-54-42-46(43-55-58)52-40-45-36-32-31-33-37-45)57-49(51)39-35-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h31-33,36-37,46-47H,3-30,34-35,38-44H2,1-2H3
InChIKey VODQRJVOWZRKST-UHFFFAOYSA-N
Molecular Weight 835.201 g/mol
SMILES C(C(COC(=O)CCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCC)OP1OCC(CO1)OCc1ccccc1