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Details

Stereochemistry MIXED
Molecular Formula C13H20N2O4
Molecular Weight 268.3089
Optical Activity ( + / - )
Defined Stereocenters 2 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of LB-100

SMILES

CN1CCN(CC1)C(=O)C2[C@@H]3CC[C@@H](O3)C2C(O)=O

InChI

InChIKey=JUQMLSGOTNKJKI-IZUQBHJASA-N
InChI=1S/C13H20N2O4/c1-14-4-6-15(7-5-14)12(16)10-8-2-3-9(19-8)11(10)13(17)18/h8-11H,2-7H2,1H3,(H,17,18)/t8-,9+,10?,11?/m0/s1

HIDE SMILES / InChI

Molecular Formula C13H20N2O4
Molecular Weight 268.3089
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 2 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:32:56 UTC 2023
Edited
by admin
on Sat Dec 16 11:32:56 UTC 2023
Record UNII
0C1JUU9S0L
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
LB-100
Code English
7-Oxabicyclo[2.2.1]heptane-2-carboxylic acid, 3-[(4-methyl-1-piperazinyl)carbonyl]-, (1R,4S)-rel-
Systematic Name English
3-[(4-Methylpiperazin-1-yl)carbonyl]-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid
Systematic Name English
EMPM
Common Name English
Code System Code Type Description
NCI_THESAURUS
C106430
Created by admin on Sat Dec 16 11:32:56 UTC 2023 , Edited by admin on Sat Dec 16 11:32:56 UTC 2023
PRIMARY
CAS
1632032-53-1
Created by admin on Sat Dec 16 11:32:56 UTC 2023 , Edited by admin on Sat Dec 16 11:32:56 UTC 2023
PRIMARY
EPA CompTox
DTXSID201132163
Created by admin on Sat Dec 16 11:32:56 UTC 2023 , Edited by admin on Sat Dec 16 11:32:56 UTC 2023
PRIMARY
DRUG BANK
DB15412
Created by admin on Sat Dec 16 11:32:56 UTC 2023 , Edited by admin on Sat Dec 16 11:32:56 UTC 2023
PRIMARY
MANUFACTURER PRODUCT INFORMATION
LB-100
Created by admin on Sat Dec 16 11:32:56 UTC 2023 , Edited by admin on Sat Dec 16 11:32:56 UTC 2023
PRIMARY LB-100: Catalog No.S7537LB-100 is a water soluble protein phosphatase 2A (PP2A) inhibitor. In Phase 1. LB-100 inhibits the cell growth with IC50 of 2.3 .MU.M (in BxPc-3) or 1.7 .MU.M (in Panc-1 cell). In BxPc-3, Panc-1, and SW1990 cells, LB-100 reduces the PP2A activity by 30-50%. LB-100 increases concentration of doxorubicin within cells (2.5 fold to control) and sensitizes tumor cells to the cytotoxicity of doxorubicin. LB-100 increaseds VEGF secretion, and thus enhances HIF-1.ALPHA.-VEGF mediated angiogenesis.In vivo: In a mouse pancreatic cancer xenograft model, LB-100 (2 mg/kg, i.p.) enhances chemotherapy of doxorubicin. LB-100 causes higher density of microvessel in tumors and rapid blood flow at the surface of tumors.
PUBCHEM
45101432
Created by admin on Sat Dec 16 11:32:56 UTC 2023 , Edited by admin on Sat Dec 16 11:32:56 UTC 2023
PRIMARY
FDA UNII
0C1JUU9S0L
Created by admin on Sat Dec 16 11:32:56 UTC 2023 , Edited by admin on Sat Dec 16 11:32:56 UTC 2023
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
Related Record Type Details
ACTIVE MOIETY
Originator: Lixte Biotechnology Holdings; Developer: INSERM, Lixte Biotechnology Holdings; Class: Antineoplastic, Small molecule; Mechanism of Action: Phosphoprotein phosphatase inhibitor, Protein phosphatase 2A inhibitor; Highest Development Phases: Phase I for Solid tumours, Preclinical for Depressive disorders, Haematological disorders, Research for Ischaemia; Most Recent Events: 08 Feb 2016 Lixte Biotechnology plans a proof-of-concept clinical study for Depressive disorders, 03 Feb 2016 Preclinical trials in Depressive disorders in France (unspecified route), 30 Dec 2015 LB 100 licensed to Taipei Medical University in Asia