[(3R)-1-oxidanylidene-1-[[(2R)-1-oxidanylidene-1-[(2S)-5-(6-oxidanylidenehexylamino)-2-[[(3R)-3-oxidanyltetradecanoyl]amino]pentoxy]-4-phosphonooxy-butan-2-yl]amino]tetradecan-3-yl] dodecanoate

Systemtic Name: [(3R)-1-oxidanylidene-1-[[(2R)-1-oxidanylidene-1-[(2S)-5-(6-oxidanylidenehexylamino)-2-[[(3R)-3-oxidanyltetradecanoyl]amino]pentoxy]-4-phosphonooxy-butan-2-yl]amino]tetradecan-3-yl] dodecanoate Openeye Name: [(1R)-1-[2-[[(1R)-1-[(2S)-2-[[(3R)-3-hydroxytetradecanoyl]amino]-5-(6-oxohexylamino)pentoxy]carbonyl-3-phosphonooxy-propyl]amino]-2-oxo-ethyl]dodecyl] dodecanoate CAS Name: dodecanoic acid [(3R)-1-[[(2R)-1-[(2S)-2-[[(3R)-3-hydroxy-1-oxotetradecyl]amino]-5-(6-oxohexylamino)pentoxy]-1-oxo-4-phosphonooxybutan-2-yl]amino]-1-oxotetradecan-3-yl] ester IUPAC Name: [(3R)-1-[[(2R)-1-[(2S)-2-[[(3R)-3-hydroxytetradecanoyl]amino]-5-(6-oxohexylamino)pentoxy]-1-oxo-4-phosphonooxybutan-2-yl]amino]-1-oxotetradecan-3-yl] dodecanoate Traditional Name: lauric acid [(1R)-1-[2-[[(1R)-1-[(2S)-2-[[(3R)-3-hydroxytetradecanoyl]amino]-5-(6-ketohexylamino)pentoxy]carbonyl-3-phosphonooxy-propyl]amino]-2-keto-ethyl]dodecyl] ester Formula: C55H106N3O12P MolecularWeight: 1032.416801

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(CC(=O)NC(CCCNCCCCCC=O)COC(=O)C(CCOP(=O)(O)O)NC(=O)CC(CCCCCCCCCCC)OC(=O)CCCCCCCCCCC)O

Isomeric SMILES

CCCCCCCCCCC[C@H](CC(=O)N[C@@H](CCCNCCCCCC=O)COC(=O)[C@@H](CCOP(=O)(O)O)NC(=O)C[C@@H](CCCCCCCCCCC)OC(=O)CCCCCCCCCCC)O

InChI

InChI=1S/C55H106N3O12P/c1-4-7-10-13-16-19-22-25-30-37-49(60)45-52(61)57-48(36-35-42-56-41-33-28-29-34-43-59)47-68-55(64)51(40-44-69-71(65,66)67)58-53(62)46-50(38-31-26-23-20-17-14-11-8-5-2)70-54(63)39-32-27-24-21-18-15-12-9-6-3/h43,48-51,56,60H,4-42,44-47H2,1-3H3,(H,57,61)(H,58,62)(H2,65,66,67)/t48-,49+,50+,51+/m0/s1