[(2S)-2-[[(Z)-heptadec-8-enoyl]amino]-4-phenyl-butyl] dihydrogen phosphate

Systemtic Name: [(2S)-2-[[(Z)-heptadec-8-enoyl]amino]-4-phenyl-butyl] dihydrogen phosphate Openeye Name: [(2S)-2-[[(Z)-heptadec-8-enoyl]amino]-4-phenyl-butyl] dihydrogen phosphate CAS Name: [(2S)-2-[[(Z)-1-oxoheptadec-8-enyl]amino]-4-phenylbutyl] dihydrogen phosphate IUPAC Name: [(2S)-2-[[(Z)-heptadec-8-enoyl]amino]-4-phenylbutyl] dihydrogen phosphate Traditional Name: [(2S)-2-[[(Z)-heptadec-8-enoyl]amino]-4-phenyl-butyl] dihydrogen phosphate Formula: C27H46NO5P MolecularWeight: 495.631601

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCC(=O)NC(CCC1=CC=CC=C1)COP(=O)(O)O

Isomeric SMILES

CCCCCCCC/C=C\CCCCCCC(=O)N[C@@H](CCC1=CC=CC=C1)COP(=O)(O)O

InChI

InChI=1S/C27H46NO5P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-21-27(29)28-26(24-33-34(30,31)32)23-22-25-19-16-15-17-20-25/h9-10,15-17,19-20,26H,2-8,11-14,18,21-24H2,1H3,(H,28,29)(H2,30,31,32)/b10-9-/t26-/m0/s1