| Molecule Identification |
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| Common Name | Cer(d18:1/22:6(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\CCCCCCCCCCCCC InChI=1S/C40H67NO5/c1-3-5-7-8-9-10-11-12-13-14-18-21-27-33-39(45)38(35-42)41-40(46)34-28-22-26-32-37(44)31-25-20-17-15-16-19-24-30-36(43)29-23-6-4-2/h6,16-17,19-20,23-27,30-33,36-39,42-45H,3-5,7-15,18,21-22,28-29,34-35H2,1-2H3,(H,41,46)/b19-16-,20-17-,23-6-,30-24+,31-25+,32-26-,33-27+/t36-,37-,38-,39+/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-Dihydroxyoctadec-4-en-2-yl]-7,17-dihydroxydocosa-5,8,10,13,15,19-hexaenimidate | Generator |
|
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| Chemical Formula | C40H67NO5 |
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| Average Molecular Weight | 641.978 |
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| Monoisotopic Molecular Weight | 641.501924261 |
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| IUPAC Name | (5Z,7R,8E,10Z,13Z,15E,17S,19Z)-N-[(2S,3R,4E)-1,3-dihydroxyoctadec-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-dihydroxyoctadec-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\CCCCCCCCCCCCC |
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| InChI Identifier | InChI=1S/C40H67NO5/c1-3-5-7-8-9-10-11-12-13-14-18-21-27-33-39(45)38(35-42)41-40(46)34-28-22-26-32-37(44)31-25-20-17-15-16-19-24-30-36(43)29-23-6-4-2/h6,16-17,19-20,23-27,30-33,36-39,42-45H,3-5,7-15,18,21-22,28-29,34-35H2,1-2H3,(H,41,46)/b19-16-,20-17-,23-6-,30-24+,31-25+,32-26-,33-27+/t36-,37-,38-,39+/m0/s1 |
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| InChI Key | LPQMSZOLEMBZQH-CKOUIEGNSA-N |
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