acompound

Showing entry for (S)-Mandelonitrile

General Compound Information
BXGC Id	BXGC0027390
Compound Name	(S)-Mandelonitrile
Structure
Formula	C8H7NO
InchiKey	NNICRUQPODTGRU-MRVPVSSYSA-N
SMILES	O[C@@H](c1ccccc1)C#N
Inchi	InChI=1S/C8H7NO/c9-6-8(10)7-4-2-1-3-5-7/h1-5,8,10H/t8-/m1/s1
IUPAC	(2S)-2-hydroxy-2-phenylacetonitrile
Molecular Weight	133.05
Pubchem Id	439767
Chembl Id

Targets of Information Source

DrugBank

n.a

Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Groups	Target Type
Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Groups	Target Type

PDB

MNN

Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Ki nM	ic50 nM	Kd nM	Ka M-1
Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Ki nM	ic50 nM	Kd nM	Ka M-1
P52704	BXGT010944	(S)-hydroxynitrile lyase	reviewed	HNL	-	-	-	-	-
Q9LFT6	BXGT021075	Alpha-hydroxynitrile lyase	reviewed	HNL	-	-	-	-	-

Binding DB

n.a

Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Ki nM	ic50 nM	Kd nM	EC50 nM
Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Ki nM	ic50 nM	Kd nM	EC50 nM

CHEMBL

n.a

Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	width="10%">Type	Relation	value	Units
Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Type	Relation	value	Units

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF00144	Apricot	Prunus armeniaca	Fruits
BXGF00942	Odontites rubra	Odontites rubra	Others
BXGF01125	Schistostephium rotundifolium	Schistostephium rotundifolium	Others
BXGF01206	Prosopis ruscifolia	Prosopis ruscifolia	Medicinal Plant
BXGF01274	Garcinia macrophylla	Garcinia macrophylla	Medicinal Plant
BXGF01381	Siphocampylus verticillatus	Siphocampylus verticillatus	Others
BXGF01410	Viburnum chingii	Viburnum chingii	Others
BXGF01576	Maytenus loeseneri	Maytenus loeseneri	Others
BXGF01689	Aconitum kamtschaticum	Aconitum kamtschaticum	Others
BXGF01766	Maytenus serrata	Maytenus serrata	Medicinal Plant
BXGF01870	Dipteronia dyeriana	Dipteronia dyeriana	Others
BXGF01976	Podocarpus salignus	Podocarpus salignus	Medicinal Plant
BXGF01981	Psychotria bahiensis	Psychotria bahiensis	Others
BXGF02069	Plectranthus mollis	Plectranthus mollis	Medicinal Plant
BXGF02142	Dodonaea polyandra	Dodonaea polyandra	Medicinal Plant
BXGF02192	Actinidia kolomikta	Actinidia kolomikta	Medicinal Plant
BXGF02236	Murraya kwangsiensis	Murraya kwangsiensis	Medicinal Plant
BXGF02281	Veratrum stenophyllum	Veratrum stenophyllum	Others
BXGF02299	Phalaenopsis aphrodite	Phalaenopsis aphrodite	Others
BXGF02422	Sideritis syriaca	Sideritis syriaca	Medicinal Plant
BXGF02999	Prunus sibirica	Prunus sibirica	Medicinal Plant
BXGF03384	Vepris pilosa	Vepris pilosa	Others
BXGF03954	Prunus mandshurica	Prunus mandshurica	Others
BXGF04151	Ophiorrhiza blumeana	Ophiorrhiza blumeana	Others
BXGF04197	Zanthoxylum chiriquinum	Zanthoxylum chiriquinum	Others
BXGF04209	Chaenomeles sinensis	Chaenomeles sinensis	Medicinal Plant
BXGF05135	Ongokea klaineana	Ongokea klaineana	Others
BXGF05474	Gymnanthemum amygdalinum	Gymnanthemum amygdalinum	Medicinal Plant
BXGF05661	Aconitum vilmorinianum	Aconitum vilmorinianum	Others
BXGF05758	Boronella koniambiensis	Boronella koniambiensis	Others
BXGF05779	Canarium strictum	Canarium strictum	Medicinal Plant
BXGF05891	Peucedanum palustre	Peucedanum palustre	Medicinal Plant
BXGF05905	Coreopsis grandiflora	Coreopsis grandiflora	Garden Plant
BXGF06070	Perilla frutescens	Perilla frutescens	Medicinal Plant
BXGF06072	Physalis solanaceus	Physalis solanaceus	Others

The compound-realted diseases

Diseases

BXGD Id	Disease Name	CUI Disease Id	Disease Class Name	Number of targets^{?Number of targets related to compound connecting disease, higher numbers indicate the compound is more associated with the disease}