(2R)-3-oxidanyl-2-(3-phosphonopropylamino)-3-(3,7,11,15-tetramethylhexadecoxy)-2-(3,7,11,15-tetramethyl-3-oxidanyl-hexadecoxy)propanoic acid

Systemtic Name: (2R)-3-oxidanyl-2-(3-phosphonopropylamino)-3-(3,7,11,15-tetramethylhexadecoxy)-2-(3,7,11,15-tetramethyl-3-oxidanyl-hexadecoxy)propanoic acid Openeye Name: (2R)-3-hydroxy-2-(3-hydroxy-3,7,11,15-tetramethyl-hexadecoxy)-2-(3-phosphonopropylamino)-3-(3,7,11,15-tetramethylhexadecoxy)propanoic acid CAS Name: (2R)-3-hydroxy-2-(3-hydroxy-3,7,11,15-tetramethylhexadecoxy)-2-(3-phosphonopropylamino)-3-(3,7,11,15-tetramethylhexadecoxy)propanoic acid IUPAC Name: (2R)-3-hydroxy-2-(3-hydroxy-3,7,11,15-tetramethylhexadecoxy)-2-(3-phosphonopropylamino)-3-(3,7,11,15-tetramethylhexadecoxy)propanoic acid Traditional Name: (2R)-3-hydroxy-2-(3-hydroxy-3,7,11,15-tetramethyl-hexadecoxy)-2-(3-phosphonopropylamino)-3-(3,7,11,15-tetramethylhexadecoxy)propionic acid Formula: C46H94NO9P MolecularWeight: 836.213621

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)CCCC(C)CCCC(C)CCOC(C(C(=O)O)(NCCCP(=O)(O)O)OCCC(C)(CCCC(C)CCCC(C)CCCC(C)C)O)O

Isomeric SMILES

CC(C)CCCC(C)CCCC(C)CCCC(C)CCOC([C@@](C(=O)O)(NCCCP(=O)(O)O)OCCC(C)(CCCC(C)CCCC(C)CCCC(C)C)O)O

InChI

InChI=1S/C46H94NO9P/c1-36(2)18-11-20-38(5)22-13-24-40(7)25-15-27-42(9)29-33-55-44(50)46(43(48)49,47-32-17-35-57(52,53)54)56-34-31-45(10,51)30-16-28-41(8)26-14-23-39(6)21-12-19-37(3)4/h36-42,44,47,50-51H,11-35H2,1-10H3,(H,48,49)(H2,52,53,54)/t38?,39?,40?,41?,42?,44?,45?,46-/m0/s1