| Molecule Identification |
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| Common Name | Cer(t18:0/22:6(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@H](O)CCCCCCCCCCCCCC InChI=1S/C40H69NO6/c1-3-5-7-8-9-10-11-12-13-17-20-26-32-38(45)40(47)37(34-42)41-39(46)33-27-21-25-31-36(44)30-24-19-16-14-15-18-23-29-35(43)28-22-6-4-2/h6,15-16,18-19,22-25,29-31,35-38,40,42-45,47H,3-5,7-14,17,20-21,26-28,32-34H2,1-2H3,(H,41,46)/b18-15-,19-16-,22-6-,29-23+,30-24+,31-25-/t35-,36-,37-,38+,40+/m0/s1 |
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| Synonyms | | Value | Source |
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| (5Z,7R,10Z,17S,19Z)-7,17-Dihydroxy-N-[(2S,3R,4R)-1,3,4-trihydroxyoctadecan-2-yl]docosa-5,8,10,13,15,19-hexaenimidate | Generator |
|
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| Chemical Formula | C40H69NO6 |
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| Average Molecular Weight | 659.993 |
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| Monoisotopic Molecular Weight | 659.512488946 |
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| IUPAC Name | (5Z,7R,8E,10Z,13Z,15E,17S,19Z)-7,17-dihydroxy-N-[(2S,3R,4R)-1,3,4-trihydroxyoctadecan-2-yl]docosa-5,8,10,13,15,19-hexaenamide |
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| Traditional Name | (5Z,7R,8E,10Z,13Z,15E,17S,19Z)-7,17-dihydroxy-N-[(2S,3R,4R)-1,3,4-trihydroxyoctadecan-2-yl]docosa-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@H](O)CCCCCCCCCCCCCC |
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| InChI Identifier | InChI=1S/C40H69NO6/c1-3-5-7-8-9-10-11-12-13-17-20-26-32-38(45)40(47)37(34-42)41-39(46)33-27-21-25-31-36(44)30-24-19-16-14-15-18-23-29-35(43)28-22-6-4-2/h6,15-16,18-19,22-25,29-31,35-38,40,42-45,47H,3-5,7-14,17,20-21,26-28,32-34H2,1-2H3,(H,41,46)/b18-15-,19-16-,22-6-,29-23+,30-24+,31-25-/t35-,36-,37-,38+,40+/m0/s1 |
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| InChI Key | KBTWSFWXGHHRCT-IOIXMKGLSA-N |
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