A1H52

7.10 monoacylglycerol (R-form)

Created: 2024-03-11
Last modified:  2024-04-03

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Chemical Details

Formal Charge0
Atom Count62
Chiral Atom Count1
Bond Count61
Aromatic Bond Count0
2D diagram of A1H52

Chemical Component Summary

Name7.10 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
FormulaC20 H38 O4
Molecular Weight342.513
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESCACTVS3.385CCCCCCCCCC=CCCCCCC(=O)OC[CH](O)CO
SMILESOpenEye OEToolkits2.0.7CCCCCCCCCC=CCCCCCC(=O)OCC(CO)O
Canonical SMILESCACTVS3.385 CCCCCCCCC/C=C/CCCCCC(=O)OC[C@H](O)CO
Canonical SMILESOpenEye OEToolkits2.0.7 CCCCCCCCC/C=C/CCCCCC(=O)OC[C@@H](CO)O
InChIInChI1.06 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
InChIKeyInChI1.06 XTALOCBNHVPVKU-GNISGLHKSA-N