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Details

Stereochemistry ABSOLUTE
Molecular Formula C9H12BNO4.ClH
Molecular Weight 245.468
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BORONOPHENYLALANINE HYDROCHLORIDE

SMILES

Cl.N[C@@H](CC1=CC=C(C=C1)B(O)O)C(O)=O

InChI

InChIKey=ITAYDCRFNXQNBL-QRPNPIFTSA-N
InChI=1S/C9H12BNO4.ClH/c11-8(9(12)13)5-6-1-3-7(4-2-6)10(14)15;/h1-4,8,14-15H,5,11H2,(H,12,13);1H/t8-;/m0./s1

HIDE SMILES / InChI

Molecular Formula C9H12BNO4
Molecular Weight 209.007
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Targets

Targets

Primary TargetPharmacologyConditionPotency
PubMed

PubMed

TitleDatePubMed
Boron neutron capture therapy: effects of split dose and overall treatment time.
2001 Apr
The hamster cheek pouch as a model of oral cancer for boron neutron capture therapy studies: selective delivery of boron by boronophenylalanine.
2001 Dec 15
The early successful treatment of glioblastoma patients with modified boron neutron capture therapy. Report of two cases.
2003 Nov
Delivery of (10)boron to oral squamous cell carcinoma using boronophenylalanine and borocaptate sodium for boron neutron capture therapy.
2004 May
Effectiveness of BNCT for recurrent head and neck malignancies.
2004 Nov
Boronated epidermal growth factor as a delivery agent for neutron capture therapy of EGF receptor positive gliomas.
2004 Nov
Radiobiology of BNCT mediated by GB-10 and GB-10+BPA in experimental oral cancer.
2004 Nov
Boron-containing nucleosides as potential delivery agents for neutron capture therapy of brain tumors.
2004 Sep 1
Impact of intra-arterial administration of boron compounds on dose-volume histograms in boron neutron capture therapy for recurrent head-and-neck tumors.
2006 Dec 1
Pharmacokinetic study of BSH and BPA in simultaneous use for BNCT.
2006 Jul
Homogeneous boron targeting of heterogeneous tumors for boron neutron capture therapy (BNCT): chemical analyses in the hamster cheek pouch oral cancer model.
2006 Oct
Comments to article: Henriksson R et al., Boron neutron capture therapy (BNCT) for glioblastoma multiforme: a phase II study evaluating a prolonged high-dose of boronophenylalanine (BPA) Radiother Oncol (2008).
2008 Aug
Role of p53 mutation in the effect of boron neutron capture therapy on oral squamous cell carcinoma.
2009 Dec 11
Boron neutron capture therapy for newly diagnosed glioblastoma.
2009 Jan
In vitro neutron irradiation of glioma and endothelial cultured cells.
2009 Jul
Calculations of dose distributions in the lungs of a rat model irradiated in the thermal column of the TRIGA reactor in Pavia.
2009 Jul
Selective uptake of p-boronophenylalanine by osteosarcoma cells for boron neutron capture therapy.
2009 Jul
Planned fractionated boron neutron capture therapy using epithermal neutrons for a patient with recurrent squamous cell carcinoma in the temporal bone: a case report.
2009 Mar
Insight into the mechanisms underlying tumor response to boron neutron capture therapy in the hamster cheek pouch oral cancer model.
2009 May
Aryl boronic acid inhibition of synthetic melanin polymerization.
2010 Aug 1
Boron neutron capture therapy induces apoptosis of glioma cells through Bcl-2/Bax.
2010 Dec 2
Early effect of boron neutron capture therapy mediated by boronophenylalanine (BPA-BNCT) on mast cells in premalignant tissue and tumors of the hamster cheek pouch.
2010 May
Patents
Substance Class Chemical
Created
by admin
on Sat Dec 16 01:06:17 GMT 2023
Edited
by admin
on Sat Dec 16 01:06:17 GMT 2023
Record UNII
O37300B3AP
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BORONOPHENYLALANINE HYDROCHLORIDE
Systematic Name English
L-PHENYLALANINE, 4-BORONO-, HYDROCHLORIDE
Systematic Name English
BPA-HCL
Brand Name English
L-PHENYLALANINE, 4-BORONO-, HYDROCHLORIDE, (-)-
Systematic Name English
BOROFALAN HYDROCHLORIDE
Common Name English
BORONOPHENYLALANINE HCL [INCI]
Common Name English
Code System Code Type Description
FDA UNII
O37300B3AP
Created by admin on Sat Dec 16 01:06:17 GMT 2023 , Edited by admin on Sat Dec 16 01:06:17 GMT 2023
PRIMARY
PUBCHEM
71423166
Created by admin on Sat Dec 16 01:06:17 GMT 2023 , Edited by admin on Sat Dec 16 01:06:17 GMT 2023
PRIMARY
EPA CompTox
DTXSID30227243
Created by admin on Sat Dec 16 01:06:17 GMT 2023 , Edited by admin on Sat Dec 16 01:06:17 GMT 2023
PRIMARY
CAS
76410-59-8
Created by admin on Sat Dec 16 01:06:17 GMT 2023 , Edited by admin on Sat Dec 16 01:06:17 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE