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

Details

Stereochemistry ABSOLUTE
Molecular Formula C24H32N6O11
Molecular Weight 580.5445
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TAVILERMIDE

SMILES

NCCCC[C@@H]1NC(=O)[C@H](CCC(O)=O)NC(=O)C2=C(OCC[C@H](NC1=O)C(=O)NCC(O)=O)C=CC(=C2)[N+]([O-])=O

InChI

InChIKey=DVJXNXPFYJIACK-ULQDDVLXSA-N
InChI=1S/C24H32N6O11/c25-9-2-1-3-15-23(37)29-17(22(36)26-12-20(33)34)8-10-41-18-6-4-13(30(39)40)11-14(18)21(35)27-16(24(38)28-15)5-7-19(31)32/h4,6,11,15-17H,1-3,5,7-10,12,25H2,(H,26,36)(H,27,35)(H,28,38)(H,29,37)(H,31,32)(H,33,34)/t15-,16-,17-/m0/s1

HIDE SMILES / InChI

Molecular Formula C24H32N6O11
Molecular Weight 580.5445
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 05:40:17 UTC 2023
Edited
by admin
on Sat Dec 16 05:40:17 UTC 2023
Record UNII
NMG938VJ6T
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TAVILERMIDE
INN   USAN   WHO-DD  
INN   USAN  
Official Name English
MIM-D3
Code English
tavilermide [INN]
Common Name English
3-(4R,7S,10S)-7-(4-AMINOBUTYL)-4-((CARBOXYMETHYL)AMINO)CARBONYL)-14-NITRO-6,9,12-TRIOXO-3,4,5,6,7,8,9,10,11,12-DECAHYDRO-2H-1,5,8,11-BENZOXATRIAZACYCLOTETRADECIN-10-YL) PROPANOIC ACID
Common Name English
TAVILERMIDE [USAN]
Common Name English
GLYCINE, N-(2-HYDROXY-5-NITROBENZOYL)-L-.ALPHA.-GLUTAMYL-L-LYSYL-L-HOMOSERYL-, CYCLIC (1->3)-ETHER
Common Name English
D-3
Code English
Tavilermide [WHO-DD]
Common Name English
Code System Code Type Description
INN
10161
Created by admin on Sat Dec 16 05:40:17 UTC 2023 , Edited by admin on Sat Dec 16 05:40:17 UTC 2023
PRIMARY
PUBCHEM
9808372
Created by admin on Sat Dec 16 05:40:17 UTC 2023 , Edited by admin on Sat Dec 16 05:40:17 UTC 2023
PRIMARY
ChEMBL
CHEMBL3544981
Created by admin on Sat Dec 16 05:40:17 UTC 2023 , Edited by admin on Sat Dec 16 05:40:17 UTC 2023
PRIMARY
FDA UNII
NMG938VJ6T
Created by admin on Sat Dec 16 05:40:17 UTC 2023 , Edited by admin on Sat Dec 16 05:40:17 UTC 2023
PRIMARY
CAS
263251-78-1
Created by admin on Sat Dec 16 05:40:17 UTC 2023 , Edited by admin on Sat Dec 16 05:40:17 UTC 2023
PRIMARY
EPA CompTox
DTXSID00180937
Created by admin on Sat Dec 16 05:40:17 UTC 2023 , Edited by admin on Sat Dec 16 05:40:17 UTC 2023
PRIMARY
USAN
BC-126
Created by admin on Sat Dec 16 05:40:17 UTC 2023 , Edited by admin on Sat Dec 16 05:40:17 UTC 2023
PRIMARY
WIKIPEDIA
Tavilermide
Created by admin on Sat Dec 16 05:40:17 UTC 2023 , Edited by admin on Sat Dec 16 05:40:17 UTC 2023
PRIMARY
NCI_THESAURUS
C174759
Created by admin on Sat Dec 16 05:40:17 UTC 2023 , Edited by admin on Sat Dec 16 05:40:17 UTC 2023
PRIMARY
SMS_ID
300000034366
Created by admin on Sat Dec 16 05:40:17 UTC 2023 , Edited by admin on Sat Dec 16 05:40:17 UTC 2023
PRIMARY
DRUG BANK
DB12441
Created by admin on Sat Dec 16 05:40:17 UTC 2023 , Edited by admin on Sat Dec 16 05:40:17 UTC 2023
PRIMARY
Related Record Type Details
TARGET -> AGONIST
SALT/SOLVATE -> PARENT
Related Record Type Details
ACTIVE MOIETY