Molecule Identification |
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Common Name | Cer(d16:1/22:6(5Z,8E,10Z,13Z,15E,19Z)-2OH(7S, 17S)) |
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Definition | 2734 |
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Structure | [H][C@@](CO)(NC(=O)CCC\C=C/[C@@H](O)\C=C\C=C/C\C=C/C=C/[C@@H](O)C\C=C/CC)[C@H](O)\C=C\CCCCCCCCCCC InChI=1S/C38H63NO5/c1-3-5-7-8-9-10-11-12-16-19-25-31-37(43)36(33-40)39-38(44)32-26-20-24-30-35(42)29-23-18-15-13-14-17-22-28-34(41)27-21-6-4-2/h6,14-15,17-18,21-25,28-31,34-37,40-43H,3-5,7-13,16,19-20,26-27,32-33H2,1-2H3,(H,39,44)/b17-14-,18-15-,21-6-,28-22+,29-23+,30-24-,31-25+/t34-,35-,36-,37+/m0/s1 |
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Synonyms | Value | Source |
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(5Z,7R,8E,10Z,13Z,17S,19Z)-N-[(2S,3R,4E)-1,3-Dihydroxyhexadec-4-en-2-yl]-7,17-dihydroxydocosa-5,8,10,13,15,19-hexaenimidate | Generator |
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Chemical Formula | C38H63NO5 |
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Average Molecular Weight | 613.924 |
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Monoisotopic Molecular Weight | 613.470624133 |
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IUPAC Name | (5Z,7R,8E,10Z,13Z,15E,17S,19Z)-N-[(2S,3R,4E)-1,3-dihydroxyhexadec-4-en-2-yl]-7,17-dihydroxydocosa-5,8,10,13,15,19-hexaenamide |
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Traditional Name | (5Z,7R,8E,10Z,13Z,15E,17S,19Z)-N-[(2S,3R,4E)-1,3-dihydroxyhexadec-4-en-2-yl]-7,17-dihydroxydocosa-5,8,10,13,15,19-hexaenamide |
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CAS Registry Number | Not Available |
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SMILES | [H][C@@](CO)(NC(=O)CCC\C=C/[C@@H](O)\C=C\C=C/C\C=C/C=C/[C@@H](O)C\C=C/CC)[C@H](O)\C=C\CCCCCCCCCCC |
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InChI Identifier | InChI=1S/C38H63NO5/c1-3-5-7-8-9-10-11-12-16-19-25-31-37(43)36(33-40)39-38(44)32-26-20-24-30-35(42)29-23-18-15-13-14-17-22-28-34(41)27-21-6-4-2/h6,14-15,17-18,21-25,28-31,34-37,40-43H,3-5,7-13,16,19-20,26-27,32-33H2,1-2H3,(H,39,44)/b17-14-,18-15-,21-6-,28-22+,29-23+,30-24-,31-25+/t34-,35-,36-,37+/m0/s1 |
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InChI Key | SHUOTICKTZGWNO-MUWJJTHSSA-N |
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