U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula 2C19H29N5O2.C4H6O4
Molecular Weight 837.0198
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of LAVOLTIDINE SUCCINATE

SMILES

OC(=O)CCC(O)=O.CN1N=C(CO)N=C1NCCCOC2=CC=CC(CN3CCCCC3)=C2.CN4N=C(CO)N=C4NCCCOC5=CC=CC(CN6CCCCC6)=C5

InChI

InChIKey=IRLVOMNMSKSKMH-UHFFFAOYSA-N
InChI=1S/2C19H29N5O2.C4H6O4/c2*1-23-19(21-18(15-25)22-23)20-9-6-12-26-17-8-5-7-16(13-17)14-24-10-3-2-4-11-24;5-3(6)1-2-4(7)8/h2*5,7-8,13,25H,2-4,6,9-12,14-15H2,1H3,(H,20,21,22);1-2H2,(H,5,6)(H,7,8)

HIDE SMILES / InChI

Molecular Formula C4H6O4
Molecular Weight 118.088
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C19H29N5O2
Molecular Weight 359.4659
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:35:40 UTC 2023
Edited
by admin
on Fri Dec 15 15:35:40 UTC 2023
Record UNII
YSJ55YKG2J
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
LAVOLTIDINE SUCCINATE
USAN  
USAN  
Official Name English
LAVOLTIDINE SUCCINATE [USAN]
Common Name English
AH 23844 HEMISUCCINATE
Code English
AH-23844 HEMISUCCINATE
Code English
1-METHYL-5-((3-((.ALPHA.-PIPERIDINO-M-TOLYL)OXY)PROPYL)AMINO)-1H-1,2,4-TRIAZOLE-3-METHANOL SUCCINATE (2:1) (SALT)
Systematic Name English
LOXOTIDINE SUCCINATE
Common Name English
AH-23844A
Code English
1-METHYL-5-((3-(3-(1-PIPERIDINYLMETHYL)PHENOXY)PROPYL)AMINO)-1H-1,2,4-TRIAZOLE-3-METHANOL
Systematic Name English
AH 23844A
Code English
1H-1,2,4-TRIAZOLE-3-METHANOL, 1-METHYL-5-((3-(3-(1-PIPERIDINYLMETHYL)PHENOXY)PROPYL)AMINO)-, BUTANEDIOATE (2:1) (SALT)
Systematic Name English
Code System Code Type Description
NCI_THESAURUS
C170099
Created by admin on Fri Dec 15 15:35:40 UTC 2023 , Edited by admin on Fri Dec 15 15:35:40 UTC 2023
PRIMARY
USAN
BB-34
Created by admin on Fri Dec 15 15:35:40 UTC 2023 , Edited by admin on Fri Dec 15 15:35:40 UTC 2023
PRIMARY
FDA UNII
YSJ55YKG2J
Created by admin on Fri Dec 15 15:35:40 UTC 2023 , Edited by admin on Fri Dec 15 15:35:40 UTC 2023
PRIMARY
ChEMBL
CHEMBL2110857
Created by admin on Fri Dec 15 15:35:40 UTC 2023 , Edited by admin on Fri Dec 15 15:35:40 UTC 2023
PRIMARY
PUBCHEM
55472
Created by admin on Fri Dec 15 15:35:40 UTC 2023 , Edited by admin on Fri Dec 15 15:35:40 UTC 2023
PRIMARY
EPA CompTox
DTXSID50235426
Created by admin on Fri Dec 15 15:35:40 UTC 2023 , Edited by admin on Fri Dec 15 15:35:40 UTC 2023
PRIMARY
CAS
86160-82-9
Created by admin on Fri Dec 15 15:35:40 UTC 2023 , Edited by admin on Fri Dec 15 15:35:40 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY