BitterDB ID=231

Guaifenesin

BitterDB id=231

References for the compound bitterness

	Resource	Comment
[1]	Merck Index Monograph Number: 4555	Slightly bitter aromatic taste

Known bitter receptors targets:

There is no available data on associated receptors

Sensory data about the compound bitterness:

There is no sensory data available

Properties:

Mol. Weight: 198.2200 [g/mol]	AlogP(octanol-water): 0.42720
# Hydrogen Bond Donor: 2	# Hydrogen Bond Acceptor: 4
# Aromatic Rings: 1	# Rings: 1
# Rotatable Bonds: 5
Rat Acute Oral LD50: 1510 [mg/kg B.W.]

Identifiers:

CAS Registry Number: 93-14-1

Formula: C10H14O4

IUPAC Systematic Name:

SMILES:

Canonical SMILES:

InChI Key: HSRJKNPTNIJEKV-UHFFFAOYSA-N

Links:

[1]	PubChem	3516
[2]	ZINC	ZINC000000000353	ZINC000000394284
[3]	DrugBank	DB00874
[4]	Guide to PHARMACOLOGY	7617