1-hydroxybutan-2-yl docosanoate;1-hydroxybutan-2-yl (Z)-docos-13-enoate;1-hydroxybutan-2-yl (E)-docos-13-enoate;1-hydroxybutan-2-yl henicosanoate;1-hydroxybutan-2-yl (11Z,14Z)-icosa-11,14-dienoate;1-hydroxybutan-2-yl (5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoate;1-hydroxybutan-2-yl (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate;1-hydroxybutan-2-yl (8Z,11Z,14Z,17Z)-icosa-8,11,14,17-tetraenoate;1-hydroxybutan-2-yl (8Z,11Z,14Z)-icosa-8,11,14-trienoate;1-hydroxybutan-2-yl (11Z,14Z,17Z)-icosa-11,14,17-trienoate;1-hydroxybutan-2-yl (Z)-icos-11-enoate;1-hydroxybutan-2-yl (Z)-icos-13-enoate

C295H540O36 — CID 162164372

IUPAC1-hydroxybutan-2-yl docosanoate;1-hydroxybutan-2-yl (Z)-docos-13-enoate;1-hydroxybutan-2-yl (E)-docos-13-enoate;1-hydroxybutan-2-yl henicosanoate;1-hydroxybutan-2-yl (11Z,14Z)-icosa-11,14-dienoate;1-hydroxybutan-2-yl (5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoate;1-hydroxybutan-2-yl (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate;1-hydroxybutan-2-yl (8Z,11Z,14Z,17Z)-icosa-8,11,14,17-tetraenoate;1-hydroxybutan-2-yl (8Z,11Z,14Z)-icosa-8,11,14-trienoate;1-hydroxybutan-2-yl (11Z,14Z,17Z)-icosa-11,14,17-trienoate;1-hydroxybutan-2-yl (Z)-icos-11-enoate;1-hydroxybutan-2-yl (Z)-icos-13-enoate
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)OC(CC)CO.CC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCC(=O)OC(CC)CO.CC/C=C\C/C=C\C/C=C\CCCCCCCCCC(=O)OC(CC)CO.CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)OC(CC)CO.CCCCC/C=C\C/C=C\C/C=C\CCCCCCC(=O)OC(CC)CO.CCCCC/C=C\C/C=C\CCCCCCCCCC(=O)OC(CC)CO.CCCCCC/C=C\CCCCCCCCCCCC(=O)OC(CC)CO.CCCCCCCC/C=C/CCCCCCCCCCCC(=O)OC(CC)CO.CCCCCCCC/C=C\CCCCCCCCCC(=O)OC(CC)CO.CCCCCCCC/C=C\CCCCCCCCCCCC(=O)OC(CC)CO.CCCCCCCCCCCCCCCCCCCCC(=O)OC(CC)CO.CCCCCCCCCCCCCCCCCCCCCC(=O)OC(CC)CO
InChIInChI=1S/C26H52O3.2C26H50O3.C25H50O3.2C24H46O3.C24H44O3.2C24H42O3.2C24H40O3.C24H38O3/c3*1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-26(28)29-25(4-2)24-27;1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-25(27)28-24(4-2)23-26;8*1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24(26)27-23(4-2)22-25/h25,27H,3-24H2,1-2H3;2*11-12,25,27H,3-10,13-24H2,1-2H3;24,26H,3-23H2,1-2H3;11-12,23,25H,3-10,13-22H2,1-2H3;9-10,23,25H,3-8,11-22H2,1-2H3;8-9,11-12,23,25H,3-7,10,13-22H2,1-2H3;8-9,11-12,14-15,23,25H,3-7,10,13,16-22H2,1-2H3;5-6,8-9,11-12,23,25H,3-4,7,10,13-22H2,1-2H3;8-9,11-12,14-15,17-18,23,25H,3-7,10,13,16,19-22H2,1-2H3;5-6,8-9,11-12,14-15,23,25H,3-4,7,10,13,16-22H2,1-2H3;5-6,8-9,11-12,14-15,17-18,23,25H,3-4,7,10,13,16,19-22H2,1-2H3/b;12-11+;12-11-;;12-11-;10-9-;9-8-,12-11-;9-8-,12-11-,15-14-;6-5-,9-8-,12-11-;9-8-,12-11-,15-14-,18-17-;6-5-,9-8-,12-11-,15-14-;6-5-,9-8-,12-11-,15-14-,18-17-
InChIKeyZMXUGDFBNZVTGD-RUCHEKFZSA-N
MW4663.53 g/mol
LogP85.24
Rot. Bonds234

About 1-hydroxybutan-2-yl docosanoate;1-hydroxybutan-2-yl (Z)-docos-13-enoate;1-hydroxybutan-2-yl (E)-docos-13-enoate;1-hydroxybutan-2-yl henicosanoate;1-hydroxybutan-2-yl (11Z,14Z)-icosa-11,14-dienoate;1-hydroxybutan-2-yl (5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoate;1-hydroxybutan-2-yl (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate;1-hydroxybutan-2-yl (8Z,11Z,14Z,17Z)-icosa-8,11,14,17-tetraenoate;1-hydroxybutan-2-yl (8Z,11Z,14Z)-icosa-8,11,14-trienoate;1-hydroxybutan-2-yl (11Z,14Z,17Z)-icosa-11,14,17-trienoate;1-hydroxybutan-2-yl (Z)-icos-11-enoate;1-hydroxybutan-2-yl (Z)-icos-13-enoate

1-hydroxybutan-2-yl docosanoate;1-hydroxybutan-2-yl (Z)-docos-13-enoate;1-hydroxybutan-2-yl (E)-docos-13-enoate;1-hydroxybutan-2-yl henicosanoate;1-hydroxybutan-2-yl (11Z,14Z)-icosa-11,14-dienoate;1-hydroxybutan-2-yl (5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoate;1-hydroxybutan-2-yl (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate;1-hydroxybutan-2-yl (8Z,11Z,14Z,17Z)-icosa-8,11,14,17-tetraenoate;1-hydroxybutan-2-yl (8Z,11Z,14Z)-icosa-8,11,14-trienoate;1-hydroxybutan-2-yl (11Z,14Z,17Z)-icosa-11,14,17-trienoate;1-hydroxybutan-2-yl (Z)-icos-11-enoate;1-hydroxybutan-2-yl (Z)-icos-13-enoate (PubChem CID 162164372) has the molecular formula C295H540O36 and a molecular weight of 4663.53 g/mol. Its IUPAC name is 1-hydroxybutan-2-yl docosanoate;1-hydroxybutan-2-yl (Z)-docos-13-enoate;1-hydroxybutan-2-yl (E)-docos-13-enoate;1-hydroxybutan-2-yl henicosanoate;1-hydroxybutan-2-yl (11Z,14Z)-icosa-11,14-dienoate;1-hydroxybutan-2-yl (5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoate;1-hydroxybutan-2-yl (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate;1-hydroxybutan-2-yl (8Z,11Z,14Z,17Z)-icosa-8,11,14,17-tetraenoate;1-hydroxybutan-2-yl (8Z,11Z,14Z)-icosa-8,11,14-trienoate;1-hydroxybutan-2-yl (11Z,14Z,17Z)-icosa-11,14,17-trienoate;1-hydroxybutan-2-yl (Z)-icos-11-enoate;1-hydroxybutan-2-yl (Z)-icos-13-enoate.

Molecular Properties

Compound Name1-hydroxybutan-2-yl docosanoate;1-hydroxybutan-2-yl (Z)-docos-13-enoate;1-hydroxybutan-2-yl (E)-docos-13-enoate;1-hydroxybutan-2-yl henicosanoate;1-hydroxybutan-2-yl (11Z,14Z)-icosa-11,14-dienoate;1-hydroxybutan-2-yl (5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoate;1-hydroxybutan-2-yl (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate;1-hydroxybutan-2-yl (8Z,11Z,14Z,17Z)-icosa-8,11,14,17-tetraenoate;1-hydroxybutan-2-yl (8Z,11Z,14Z)-icosa-8,11,14-trienoate;1-hydroxybutan-2-yl (11Z,14Z,17Z)-icosa-11,14,17-trienoate;1-hydroxybutan-2-yl (Z)-icos-11-enoate;1-hydroxybutan-2-yl (Z)-icos-13-enoate
PubChem CID162164372
Molecular FormulaC295H540O36
Molecular Weight4663.53 g/mol
Exact Mass4660.04
IUPAC Name1-hydroxybutan-2-yl docosanoate;1-hydroxybutan-2-yl (Z)-docos-13-enoate;1-hydroxybutan-2-yl (E)-docos-13-enoate;1-hydroxybutan-2-yl henicosanoate;1-hydroxybutan-2-yl (11Z,14Z)-icosa-11,14-dienoate;1-hydroxybutan-2-yl (5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoate;1-hydroxybutan-2-yl (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate;1-hydroxybutan-2-yl (8Z,11Z,14Z,17Z)-icosa-8,11,14,17-tetraenoate;1-hydroxybutan-2-yl (8Z,11Z,14Z)-icosa-8,11,14-trienoate;1-hydroxybutan-2-yl (11Z,14Z,17Z)-icosa-11,14,17-trienoate;1-hydroxybutan-2-yl (Z)-icos-11-enoate;1-hydroxybutan-2-yl (Z)-icos-13-enoate
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)OC(CC)CO.CC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCC(=O)OC(CC)CO.CC/C=C\C/C=C\C/C=C\CCCCCCCCCC(=O)OC(CC)CO.CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)OC(CC)CO.CCCCC/C=C\C/C=C\C/C=C\CCCCCCC(=O)OC(CC)CO.CCCCC/C=C\C/C=C\CCCCCCCCCC(=O)OC(CC)CO.CCCCCC/C=C\CCCCCCCCCCCC(=O)OC(CC)CO.CCCCCCCC/C=C/CCCCCCCCCCCC(=O)OC(CC)CO.CCCCCCCC/C=C\CCCCCCCCCC(=O)OC(CC)CO.CCCCCCCC/C=C\CCCCCCCCCCCC(=O)OC(CC)CO.CCCCCCCCCCCCCCCCCCCCC(=O)OC(CC)CO.CCCCCCCCCCCCCCCCCCCCCC(=O)OC(CC)CO
InChIInChI=1S/C26H52O3.2C26H50O3.C25H50O3.2C24H46O3.C24H44O3.2C24H42O3.2C24H40O3.C24H38O3/c3*1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-26(28)29-25(4-2)24-27;1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-25(27)28-24(4-2)23-26;8*1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24(26)27-23(4-2)22-25/h25,27H,3-24H2,1-2H3;2*11-12,25,27H,3-10,13-24H2,1-2H3;24,26H,3-23H2,1-2H3;11-12,23,25H,3-10,13-22H2,1-2H3;9-10,23,25H,3-8,11-22H2,1-2H3;8-9,11-12,23,25H,3-7,10,13-22H2,1-2H3;8-9,11-12,14-15,23,25H,3-7,10,13,16-22H2,1-2H3;5-6,8-9,11-12,23,25H,3-4,7,10,13-22H2,1-2H3;8-9,11-12,14-15,17-18,23,25H,3-7,10,13,16,19-22H2,1-2H3;5-6,8-9,11-12,14-15,23,25H,3-4,7,10,13,16-22H2,1-2H3;5-6,8-9,11-12,14-15,17-18,23,25H,3-4,7,10,13,16,19-22H2,1-2H3/b;12-11+;12-11-;;12-11-;10-9-;9-8-,12-11-;9-8-,12-11-,15-14-;6-5-,9-8-,12-11-;9-8-,12-11-,15-14-,18-17-;6-5-,9-8-,12-11-,15-14-;6-5-,9-8-,12-11-,15-14-,18-17-
InChIKeyZMXUGDFBNZVTGD-RUCHEKFZSA-N
XLogP85.24
TPSA558.36 Ų
H-Bond Donors12
H-Bond Acceptors36
Rotatable Bonds234
Heavy Atoms331
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004663.53
LogP ≤ 585.24
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1036

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze 1-hydroxybutan-2-yl docosanoate;1-hydroxybutan-2-yl (Z)-docos-13-enoate;1-hydroxybutan-2-yl (E)-docos-13-enoate;1-hydroxybutan-2-yl henicosanoate;1-hydroxybutan-2-yl (11Z,14Z)-icosa-11,14-dienoate;1-hydroxybutan-2-yl (5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoate;1-hydroxybutan-2-yl (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate;1-hydroxybutan-2-yl (8Z,11Z,14Z,17Z)-icosa-8,11,14,17-tetraenoate;1-hydroxybutan-2-yl (8Z,11Z,14Z)-icosa-8,11,14-trienoate;1-hydroxybutan-2-yl (11Z,14Z,17Z)-icosa-11,14,17-trienoate;1-hydroxybutan-2-yl (Z)-icos-11-enoate;1-hydroxybutan-2-yl (Z)-icos-13-enoate with MolForge

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Related Compounds

1-hydroxybutan-2-yl (9Z,12Z,15Z)-octadeca-9,12,15-trienoate
CID 158569182
1,3-dihydroxypropan-2-yl (9Z,12Z,15Z)-octadeca-9,12,15-trienoate
CID 11674746
[(2S)-1-hydroxy-3-[(9E,12E)-octadeca-9,12-dienoyl]oxypropan-2-yl] (5E,8E,11E,14E,17E)-icosa-5,8,11,14,17-pentaenoate
CID 134752520
[(2S)-1-[(E)-hexadec-9-enoyl]oxy-3-hydroxypropan-2-yl] (5E,8E,11E,14E,17E)-icosa-5,8,11,14,17-pentaenoate
CID 134750918
[(2S)-1-hydroxy-3-icosa-5,8,11,14,17-pentaenoyloxypropan-2-yl] icosa-11,14-dienoate
CID 163071500
[(2S)-1-hydroxy-3-[(5E,8E,11E,14E,17E)-icosa-5,8,11,14,17-pentaenoyl]oxypropan-2-yl] (E)-docos-13-enoate
CID 134763123
[(2S)-1-hydroxy-3-octadec-11-enoyloxypropan-2-yl] icosa-5,8,11,14,17-pentaenoate
CID 162822590
[(2S)-3-hydroxy-2-[(6E,9E,12E,15E)-octadeca-6,9,12,15-tetraenoyl]oxypropyl] (5E,9E)-hexacosa-5,9-dienoate
CID 134717926
1,3-dihydroxypropan-2-yl (6Z,9Z,12Z)-octadeca-6,9,12-trienoate
CID 11646044
[1-[(10Z,13Z,16Z)-docosa-10,13,16-trienoyl]oxy-3-hydroxypropan-2-yl] (17Z,20Z,23Z,26Z,29Z,32Z,35Z)-octatriaconta-17,20,23,26,29,32,35-heptaenoate
CID 164501372
[3-hydroxy-2-[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyl]oxypropyl] heptacosanoate
CID 138238107
[(2S)-1-hydroxy-3-pentadecanoyloxypropan-2-yl] octadeca-9,12,15-trienoate
CID 163084885

Frequently Asked Questions

What is the IUPAC name of 1-hydroxybutan-2-yl docosanoate;1-hydroxybutan-2-yl (Z)-docos-13-enoate;1-hydroxybutan-2-yl (E)-docos-13-enoate;1-hydroxybutan-2-yl henicosanoate;1-hydroxybutan-2-yl (11Z,14Z)-icosa-11,14-dienoate;1-hydroxybutan-2-yl (5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoate;1-hydroxybutan-2-yl (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate;1-hydroxybutan-2-yl (8Z,11Z,14Z,17Z)-icosa-8,11,14,17-tetraenoate;1-hydroxybutan-2-yl (8Z,11Z,14Z)-icosa-8,11,14-trienoate;1-hydroxybutan-2-yl (11Z,14Z,17Z)-icosa-11,14,17-trienoate;1-hydroxybutan-2-yl (Z)-icos-11-enoate;1-hydroxybutan-2-yl (Z)-icos-13-enoate?
The IUPAC name of 1-hydroxybutan-2-yl docosanoate;1-hydroxybutan-2-yl (Z)-docos-13-enoate;1-hydroxybutan-2-yl (E)-docos-13-enoate;1-hydroxybutan-2-yl henicosanoate;1-hydroxybutan-2-yl (11Z,14Z)-icosa-11,14-dienoate;1-hydroxybutan-2-yl (5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoate;1-hydroxybutan-2-yl (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate;1-hydroxybutan-2-yl (8Z,11Z,14Z,17Z)-icosa-8,11,14,17-tetraenoate;1-hydroxybutan-2-yl (8Z,11Z,14Z)-icosa-8,11,14-trienoate;1-hydroxybutan-2-yl (11Z,14Z,17Z)-icosa-11,14,17-trienoate;1-hydroxybutan-2-yl (Z)-icos-11-enoate;1-hydroxybutan-2-yl (Z)-icos-13-enoate (CID 162164372) is 1-hydroxybutan-2-yl docosanoate;1-hydroxybutan-2-yl (Z)-docos-13-enoate;1-hydroxybutan-2-yl (E)-docos-13-enoate;1-hydroxybutan-2-yl henicosanoate;1-hydroxybutan-2-yl (11Z,14Z)-icosa-11,14-dienoate;1-hydroxybutan-2-yl (5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoate;1-hydroxybutan-2-yl (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate;1-hydroxybutan-2-yl (8Z,11Z,14Z,17Z)-icosa-8,11,14,17-tetraenoate;1-hydroxybutan-2-yl (8Z,11Z,14Z)-icosa-8,11,14-trienoate;1-hydroxybutan-2-yl (11Z,14Z,17Z)-icosa-11,14,17-trienoate;1-hydroxybutan-2-yl (Z)-icos-11-enoate;1-hydroxybutan-2-yl (Z)-icos-13-enoate.
What is the SMILES notation for 1-hydroxybutan-2-yl docosanoate;1-hydroxybutan-2-yl (Z)-docos-13-enoate;1-hydroxybutan-2-yl (E)-docos-13-enoate;1-hydroxybutan-2-yl henicosanoate;1-hydroxybutan-2-yl (11Z,14Z)-icosa-11,14-dienoate;1-hydroxybutan-2-yl (5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoate;1-hydroxybutan-2-yl (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate;1-hydroxybutan-2-yl (8Z,11Z,14Z,17Z)-icosa-8,11,14,17-tetraenoate;1-hydroxybutan-2-yl (8Z,11Z,14Z)-icosa-8,11,14-trienoate;1-hydroxybutan-2-yl (11Z,14Z,17Z)-icosa-11,14,17-trienoate;1-hydroxybutan-2-yl (Z)-icos-11-enoate;1-hydroxybutan-2-yl (Z)-icos-13-enoate?
The canonical SMILES for 1-hydroxybutan-2-yl docosanoate;1-hydroxybutan-2-yl (Z)-docos-13-enoate;1-hydroxybutan-2-yl (E)-docos-13-enoate;1-hydroxybutan-2-yl henicosanoate;1-hydroxybutan-2-yl (11Z,14Z)-icosa-11,14-dienoate;1-hydroxybutan-2-yl (5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoate;1-hydroxybutan-2-yl (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate;1-hydroxybutan-2-yl (8Z,11Z,14Z,17Z)-icosa-8,11,14,17-tetraenoate;1-hydroxybutan-2-yl (8Z,11Z,14Z)-icosa-8,11,14-trienoate;1-hydroxybutan-2-yl (11Z,14Z,17Z)-icosa-11,14,17-trienoate;1-hydroxybutan-2-yl (Z)-icos-11-enoate;1-hydroxybutan-2-yl (Z)-icos-13-enoate is CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)OC(CC)CO.CC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCC(=O)OC(CC)CO.CC/C=C\C/C=C\C/C=C\CCCCCCCCCC(=O)OC(CC)CO.CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)OC(CC)CO.CCCCC/C=C\C/C=C\C/C=C\CCCCCCC(=O)OC(CC)CO.CCCCC/C=C\C/C=C\CCCCCCCCCC(=O)OC(CC)CO.CCCCCC/C=C\CCCCCCCCCCCC(=O)OC(CC)CO.CCCCCCCC/C=C/CCCCCCCCCCCC(=O)OC(CC)CO.CCCCCCCC/C=C\CCCCCCCCCC(=O)OC(CC)CO.CCCCCCCC/C=C\CCCCCCCCCCCC(=O)OC(CC)CO.CCCCCCCCCCCCCCCCCCCCC(=O)OC(CC)CO.CCCCCCCCCCCCCCCCCCCCCC(=O)OC(CC)CO.
What is the InChIKey of 1-hydroxybutan-2-yl docosanoate;1-hydroxybutan-2-yl (Z)-docos-13-enoate;1-hydroxybutan-2-yl (E)-docos-13-enoate;1-hydroxybutan-2-yl henicosanoate;1-hydroxybutan-2-yl (11Z,14Z)-icosa-11,14-dienoate;1-hydroxybutan-2-yl (5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoate;1-hydroxybutan-2-yl (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate;1-hydroxybutan-2-yl (8Z,11Z,14Z,17Z)-icosa-8,11,14,17-tetraenoate;1-hydroxybutan-2-yl (8Z,11Z,14Z)-icosa-8,11,14-trienoate;1-hydroxybutan-2-yl (11Z,14Z,17Z)-icosa-11,14,17-trienoate;1-hydroxybutan-2-yl (Z)-icos-11-enoate;1-hydroxybutan-2-yl (Z)-icos-13-enoate?
The InChIKey is ZMXUGDFBNZVTGD-RUCHEKFZSA-N. The full InChI is InChI=1S/C26H52O3.2C26H50O3.C25H50O3.2C24H46O3.C24H44O3.2C24H42O3.2C24H40O3.C24H38O3/c3*1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-26(28)29-25(4-2)24-27;1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-25(27)28-24(4-2)23-26;8*1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24(26)27-23(4-2)22-25/h25,27H,3-24H2,1-2H3;2*11-12,25,27H,3-10,13-24H2,1-2H3;24,26H,3-23H2,1-2H3;11-12,23,25H,3-10,13-22H2,1-2H3;9-10,23,25H,3-8,11-22H2,1-2H3;8-9,11-12,23,25H,3-7,10,13-22H2,1-2H3;8-9,11-12,14-15,23,25H,3-7,10,13,16-22H2,1-2H3;5-6,8-9,11-12,23,25H,3-4,7,10,13-22H2,1-2H3;8-9,11-12,14-15,17-18,23,25H,3-7,10,13,16,19-22H2,1-2H3;5-6,8-9,11-12,14-15,23,25H,3-4,7,10,13,16-22H2,1-2H3;5-6,8-9,11-12,14-15,17-18,23,25H,3-4,7,10,13,16,19-22H2,1-2H3/b;12-11+;12-11-;;12-11-;10-9-;9-8-,12-11-;9-8-,12-11-,15-14-;6-5-,9-8-,12-11-;9-8-,12-11-,15-14-,18-17-;6-5-,9-8-,12-11-,15-14-;6-5-,9-8-,12-11-,15-14-,18-17-.
What are the key properties of 1-hydroxybutan-2-yl docosanoate;1-hydroxybutan-2-yl (Z)-docos-13-enoate;1-hydroxybutan-2-yl (E)-docos-13-enoate;1-hydroxybutan-2-yl henicosanoate;1-hydroxybutan-2-yl (11Z,14Z)-icosa-11,14-dienoate;1-hydroxybutan-2-yl (5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoate;1-hydroxybutan-2-yl (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate;1-hydroxybutan-2-yl (8Z,11Z,14Z,17Z)-icosa-8,11,14,17-tetraenoate;1-hydroxybutan-2-yl (8Z,11Z,14Z)-icosa-8,11,14-trienoate;1-hydroxybutan-2-yl (11Z,14Z,17Z)-icosa-11,14,17-trienoate;1-hydroxybutan-2-yl (Z)-icos-11-enoate;1-hydroxybutan-2-yl (Z)-icos-13-enoate?
1-hydroxybutan-2-yl docosanoate;1-hydroxybutan-2-yl (Z)-docos-13-enoate;1-hydroxybutan-2-yl (E)-docos-13-enoate;1-hydroxybutan-2-yl henicosanoate;1-hydroxybutan-2-yl (11Z,14Z)-icosa-11,14-dienoate;1-hydroxybutan-2-yl (5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoate;1-hydroxybutan-2-yl (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate;1-hydroxybutan-2-yl (8Z,11Z,14Z,17Z)-icosa-8,11,14,17-tetraenoate;1-hydroxybutan-2-yl (8Z,11Z,14Z)-icosa-8,11,14-trienoate;1-hydroxybutan-2-yl (11Z,14Z,17Z)-icosa-11,14,17-trienoate;1-hydroxybutan-2-yl (Z)-icos-11-enoate;1-hydroxybutan-2-yl (Z)-icos-13-enoate has a molecular weight of 4663.53 g/mol, XLogP of 85.24, 234 rotatable bonds, 12 hydrogen bond donors, and 36 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxybutan-2-yl docosanoate;1-hydroxybutan-2-yl (Z)-docos-13-enoate;1-hydroxybutan-2-yl (E)-docos-13-enoate;1-hydroxybutan-2-yl henicosanoate;1-hydroxybutan-2-yl (11Z,14Z)-icosa-11,14-dienoate;1-hydroxybutan-2-yl (5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoate;1-hydroxybutan-2-yl (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate;1-hydroxybutan-2-yl (8Z,11Z,14Z,17Z)-icosa-8,11,14,17-tetraenoate;1-hydroxybutan-2-yl (8Z,11Z,14Z)-icosa-8,11,14-trienoate;1-hydroxybutan-2-yl (11Z,14Z,17Z)-icosa-11,14,17-trienoate;1-hydroxybutan-2-yl (Z)-icos-11-enoate;1-hydroxybutan-2-yl (Z)-icos-13-enoate is sourced from PubChem (CID 162164372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).