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Bioactive Small Molecules
(2E)-4-hydroxy-3-methylbut-2-en-1-yl trihydrogen diphosphate , CAS No.E668901

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(2E)-4-hydroxy-3-methylbut-2-en-1-yl trihydrogen diphosphate , CAS No.E668901

Formula: C₅H₁₂O₈P₂
Molecular Weight: 262.089
PubChem CID: 5281976

Item Number

E668901

Grouped product items
SKU	Size	Availability	Price	Qty
E668901-1mg	1mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$999.90
E668901-5mg	5mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$2,999.90

Basic Description

Synonyms	CHEBI:15664 \| (2E)-4-hydroxy-3-methylbut-2-en-1-yl trihydrogen diphosphate \| HMBPP \| 1-Hydroxy-2-methyl-2-butenyl 4-diphosphate \| (E)-4-Hydroxy-3-methyl-but-2-enyl diphosphate \| (E)-4-Hydroxy-3-methylbut-2-enyl diphosphate \| (2E)-4-hydroxy-3-methylbut-2-e

Product Properties

ALogP	-2.4

Associated Targets(Human)

BTN3A1 Tchem Butyrophilin subfamily 3 member A1 (8 Activities)

Discover Target: BTN3A1

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

K562 (73714 Activities)

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

T-24 (2342 Activities)

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

BTN3A1 Tchem Butyrophilin subfamily 3 member A1 (291 Activities)

Discover Target: BTN3A1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Associated Targets(non-human)

Rattus norvegicus (775804 Activities)

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Names and Identifiers

IUPAC Name	[(E)-4-hydroxy-3-methylbut-2-enyl] phosphono hydrogen phosphate
INCHI	InChI=1S/C5H12O8P2/c1-5(4-6)2-3-12-15(10,11)13-14(7,8)9/h2,6H,3-4H2,1H3,(H,10,11)(H2,7,8,9)/b5-2+
InChi Key	MDSIZRKJVDMQOQ-GORDUTHDSA-N
Canonical SMILES	CC(=CCOP(=O)(O)OP(=O)(O)O)CO
Isomeric SMILES	C/C(=C\COP(=O)(O)OP(=O)(O)O)/CO
PubChem CID	5281976
Molecular Weight	262.089

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