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L2C

Summary
Name:(2S)-3-HYDROXY-2-(NONANOYLOXY)PROPYL LAURATE
Formula:C24 H46 O5
Formal charge:0
Formula weight:414.619 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.04(2S)-3-hydroxy-2-(nonanoyloxy)propyl dodecanoate
OpenEye OEToolkits1.5.0[(2S)-3-hydroxy-2-nonanoyloxy-propyl] dodecanoate

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O=C(OC(COC(=O)CCCCCCCCCCC)CO)CCCCCCCC
SMILES_CANONICALCACTVS3.341CCCCCCCCCCCC(=O)OC[C@H](CO)OC(=O)CCCCCCCC
SMILESCACTVS3.341CCCCCCCCCCCC(=O)OC[CH](CO)OC(=O)CCCCCCCC
SMILES_CANONICALOpenEye OEToolkits1.5.0CCCCCCCCCCCC(=O)OC[C@H](CO)OC(=O)CCCCCCCC
SMILESOpenEye OEToolkits1.5.0CCCCCCCCCCCC(=O)OCC(CO)OC(=O)CCCCCCCC
InChIInChI1.03InChI=1S/C24H46O5/c1-3-5-7-9-11-12-13-15-16-18-23(26)28-21-22(20-25)29-24(27)19-17-14-10-8-6-4-2/h22,25H,3-21H2,1-2H3/t22-/m0/s1
InChIKeyInChI1.03MYFVXYUACRBWGD-QFIPXVFZSA-N

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PDB entries from 2024-11-06

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