FJP
(2E,6Z)-3,7,11-trimethyldodeca-2,6,10-trien-1-yl dihydrogen phosphate
Created: | 2010-10-21 |
Last modified: | 2024-09-27 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 47 |
Chiral Atom Count | 0 |
Bond Count | 46 |
Aromatic Bond Count | 0 |
Chemical Component Summary | |
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Name | (2E,6Z)-3,7,11-trimethyldodeca-2,6,10-trien-1-yl dihydrogen phosphate |
Systematic Name (OpenEye OEToolkits) | [(2E,6Z)-3,7,11-trimethyldodeca-2,6,10-trienyl] dihydrogen phosphate |
Formula | C15 H27 O4 P |
Molecular Weight | 302.346 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=P(OC/C=C(/CC/C=C(/C)CC\C=C(/C)C)C)(O)O |
SMILES | CACTVS | 3.370 | CC(C)=CCCC(C)=CCCC(C)=CCO[P](O)(O)=O |
SMILES | OpenEye OEToolkits | 1.7.0 | CC(=CCCC(=CCCC(=CCOP(=O)(O)O)C)C)C |
Canonical SMILES | CACTVS | 3.370 | CC(C)=CCCC(\C)=C/CCC(/C)=C/CO[P](O)(O)=O |
Canonical SMILES | OpenEye OEToolkits | 1.7.0 | CC(=CCC/C(=C\CC/C(=C/COP(=O)(O)O)/C)/C)C |
InChI | InChI | 1.03 | InChI=1S/C15H27O4P/c1-13(2)7-5-8-14(3)9-6-10-15(4)11-12-19-20(16,17)18/h7,9,11H,5-6,8,10,12H2,1-4H3,(H2,16,17,18)/b14-9-,15-11+ |
InChIKey | InChI | 1.03 | ALEWCKXBHSDCCT-GNESMGCMSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 21672871 |