A1H52
7.10 monoacylglycerol (R-form)
Created: | 2024-03-11 |
Last modified: | 2024-04-03 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 62 |
Chiral Atom Count | 1 |
Bond Count | 61 |
Aromatic Bond Count | 0 |
Chemical Component Summary | |
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Name | 7.10 monoacylglycerol (R-form) |
Synonyms | [(2R)-2,3-bis(oxidanyl)propyl] (E)-heptadec-7-enoate |
Systematic Name (OpenEye OEToolkits) | [(2~{R})-2,3-bis(oxidanyl)propyl] (~{E})-heptadec-7-enoate |
Formula | C20 H38 O4 |
Molecular Weight | 342.513 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | CACTVS | 3.385 | CCCCCCCCCC=CCCCCCC(=O)OC[CH](O)CO |
SMILES | OpenEye OEToolkits | 2.0.7 | CCCCCCCCCC=CCCCCCC(=O)OCC(CO)O |
Canonical SMILES | CACTVS | 3.385 | CCCCCCCCC/C=C/CCCCCC(=O)OC[C@H](O)CO |
Canonical SMILES | OpenEye OEToolkits | 2.0.7 | CCCCCCCCC/C=C/CCCCCC(=O)OC[C@@H](CO)O |
InChI | InChI | 1.06 | InChI=1S/C20H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20(23)24-18-19(22)17-21/h10-11,19,21-22H,2-9,12-18H2,1H3/b11-10+/t19-/m1/s1 |
InChIKey | InChI | 1.06 | XTALOCBNHVPVKU-GNISGLHKSA-N |