FHP

1-HYDROXY-3,7,11-TRIMETHYLDODECA-2,6,10-TRIENE PHOSPHONIC ACID

Created: 1999-07-08
Last modified:  2020-06-05

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Chemical Details

Formal Charge0
Atom Count47
Chiral Atom Count1
Bond Count46
Aromatic Bond Count0
2D diagram of FHP

Chemical Component Summary

Name1-HYDROXY-3,7,11-TRIMETHYLDODECA-2,6,10-TRIENE PHOSPHONIC ACID
SynonymsFARNESYL HYDROXYPHOSPHONATE
Systematic Name (OpenEye OEToolkits)[(1R,2E,6E)-1-hydroxy-3,7,11-trimethyl-dodeca-2,6,10-trienyl]phosphonic acid
FormulaC15 H27 O4 P
Molecular Weight302.346
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs10.04O=P(O)(O)C(O)/C=C(/CC\C=C(/C)CC\C=C(/C)C)C
SMILESCACTVS3.341CC(C)=CCCC(C)=CCCC(C)=C[CH](O)[P](O)(O)=O
SMILESOpenEye OEToolkits1.5.0CC(=CCCC(=CCCC(=CC(O)P(=O)(O)O)C)C)C
Canonical SMILESCACTVS3.341 CC(C)=CCC/C(C)=C/CC/C(C)=C/[C@H](O)[P](O)(O)=O
Canonical SMILESOpenEye OEToolkits1.5.0 CC(=CCC/C(=C/CC/C(=C/[C@H](O)P(=O)(O)O)/C)/C)C
InChIInChI1.03 InChI=1S/C15H27O4P/c1-12(2)7-5-8-13(3)9-6-10-14(4)11-15(16)20(17,18)19/h7,9,11,15-16H,5-6,8,10H2,1-4H3,(H2,17,18,19)/b13-9+,14-11+/t15-/m1/s1
InChIKeyInChI1.03 MONZTFSZTWQCKH-UBHHKXJDSA-N

Related Resource References

Resource NameReference
PubChem 446161