ITY
Summary
Name: | icosa-5,8,11,14-tetraynoic acid |
Synonyms: | 5,8,11,14-eicosatetraynoic acid |
Formula: | C20 H24 O2 |
Formal charge: | 0 |
Formula weight: | 296.403 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.6 | icosa-5,8,11,14-tetraynoic acid |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C20H24O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h2-5,8,11,14,17-19H2,1H3,(H,21,22) |
InChIKey | InChI | 1.03 | MGLDCXPLYOWQRP-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CCCCCC#CCC#CCC#CCC#CCCCC(O)=O |
SMILES | CACTVS | 3.385 | CCCCCC#CCC#CCC#CCC#CCCCC(O)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CCCCCC#CCC#CCC#CCC#CCCCC(=O)O |
SMILES | OpenEye OEToolkits | 2.0.6 | CCCCCC#CCC#CCC#CCC#CCCCC(=O)O |