IP8

Isopentenyl phosphate

Created:	2009-10-21
Last modified:	2024-09-27

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5 entries where IP8 is found as a standalone ligand2 entries where IP8 is found in a polymer sequence

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Chemical Details
Formal Charge	0
Atom Count	21
Chiral Atom Count	0
Bond Count	20
Aromatic Bond Count	0

2D diagram of IP8

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Chemical Component Summary
Name	Isopentenyl phosphate
Synonyms	3-methylbut-3-en-1-yl dihydrogen phosphate
Systematic Name (OpenEye OEToolkits)	3-methylbut-3-enyl dihydrogen phosphate
Formula	C₅ H₁₁ O₄ P
Molecular Weight	166.112
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	O=P(OCCC(=C)\C)(O)O
SMILES	CACTVS	3.370	CC(=C)CCO[P](O)(O)=O
SMILES	OpenEye OEToolkits	1.7.6	CC(=C)CCOP(=O)(O)O
Canonical SMILES	CACTVS	3.370	CC(=C)CCO[P](O)(O)=O
Canonical SMILES	OpenEye OEToolkits	1.7.6	CC(=C)CCOP(=O)(O)O
InChI	InChI	1.03	InChI=1S/C5H11O4P/c1-5(2)3-4-9-10(6,7)8/h1,3-4H2,2H3,(H2,6,7,8)
InChIKey	InChI	1.03	QMZRXYCCCYYMHF-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	21896400
ChEMBL	CHEMBL342070
ChEBI	CHEBI:65121

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