sodium [[(2S)-1-[2,3-di(hexadecanoyloxy)propoxy]-3-oxidanyl-1-oxidanylidene-propan-2-yl]amino]-oxidanyl-phosphinate

Systemtic Name: sodium [[(2S)-1-[2,3-di(hexadecanoyloxy)propoxy]-3-oxidanyl-1-oxidanylidene-propan-2-yl]amino]-oxidanyl-phosphinate Openeye Name: sodium [[(1S)-2-[2,3-di(hexadecanoyloxy)propoxy]-1-(hydroxymethyl)-2-oxo-ethyl]amino]-hydroxy-phosphinate CAS Name: sodium [[(2S)-1-[2,3-bis(1-oxohexadecoxy)propoxy]-3-hydroxy-1-oxopropan-2-yl]amino]-hydroxyphosphinate IUPAC Name: sodium [[(2S)-1-[2,3-di(hexadecanoyloxy)propoxy]-3-hydroxy-1-oxopropan-2-yl]amino]-hydroxyphosphinate Traditional Name: sodium [[(1S)-2-[2,3-di(hexadecanoyloxy)propoxy]-2-keto-1-methylol-ethyl]amino]-hydroxy-phosphinate Formula: C38H73NNaO10P MolecularWeight: 757.950451

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OCC(COC(=O)C(CO)NP(=O)(O)[O-])OC(=O)CCCCCCCCCCCCCCC.[Na+]

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OCC(COC(=O)[C@H](CO)NP(=O)(O)[O-])OC(=O)CCCCCCCCCCCCCCC.[Na+]

InChI

InChI=1S/C38H74NO10P.Na/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-36(41)47-32-34(33-48-38(43)35(31-40)39-50(44,45)46)49-37(42)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;/h34-35,40H,3-33H2,1-2H3,(H3,39,44,45,46);/q;+1/p-1/t34?,35-;/m0./s1