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Chemical structure of TRV056

GC70069

TRV056

Also known as (3S)-3-amino-4-[[(2S)-1-[[2-[[(2S)-1-[[(2S)-1-[[(2S,3S)-1-[[(2S)-1-[(2S)-2-[[(1S)-1-carboxy-2-phenylethyl]carbamoyl]pyrrolidin-1-yl]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-2-oxoethyl]amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-4-oxobutanoic acid

TRV056 is a ligand for the Gq-biased type 1 angiotensin II receptor (AT1R)· TRV056 effectively stimulates cell signaling mediated by Gq· TRV056 can be used to develop Gq-biased AT1R agonists

ChemicalCAS812644-79-4MW1103.23FormulaC52H74N14O13
CAS number
812644-79-4
Molecular weight
1103.23
Formula
C52H74N14O13
Solubility
H2O ： 1·96 mg/mL (1·78 mM; ultrasonic and adjust pH to 2 with HCl)
InChIKey
NOMIXRQBVMELPF-IWIOKYJLSA-N
Catalogue number
GC70069
Brand
GLPBIO
Computed properties PubChem CID 11205505 · XLogP -2.3 · TPSA 438 Ų · H-bond donors 14
XLogP
-2.3
TPSA
438 Ų
H-bond donors
14
H-bond acceptors
16
Rotatable bonds
31
Heavy atoms
79

SMILES CC[C@H](C)[C@@H](C(=O)N[C@@H](CC1=CN=CN1)C(=O)N2CCC[C@H]2C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)O)NC(=O)[C@H](CC4=CC=C(C=C4)O)NC(=O)[C@H](C(C)C)NC(=O)CNC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(=O)O)N

Computed descriptors from PubChem (CID 11205505), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

Lead time
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Documents
Lot certificate of analysis and manufacturer SDS are emailed with your order confirmation.
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