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Chemical structure of Cyclo(-Gly-Tyr(PO₃H₂)-Val-Pro-Met-Leu)

GA21333

Cyclo(-Gly-Tyr(PO₃H₂)-Val-Pro-Met-Leu)

Also known as [4-[[(3S,6S,12S,15S,18S)-12-(2-methylpropyl)-15-(2-methylsulfanylethyl)-2,5,8,11,14,17-hexaoxo-3-propan-2-yl-1,4,7,10,13,16-hexazabicyclo[16.3.0]henicosan-6-yl]methyl]phenyl] dihydrogen phosphate

The cyclic hexapeptide c(GYVPML), corresponding to the autophosphorylation segment around Tyr??¹ of the PDGF receptor B subunit, serves as an inhibitor of receptor tyrosine kinase/src homology region 2 (SH2) interactions that mediate mitogenic signal transduction pathways

ChemicalCAS158778-21-3MW740.82FormulaC32H49N6O10PS
CAS number
158778-21-3
Molecular weight
740.82
Formula
C32H49N6O10PS
Solubility
Soluble in DMSO
InChIKey
SFWYJJJJFSNJTO-CPHHOOCTSA-N
Catalogue number
GA21333
Brand
GLPBIO
Computed properties PubChem CID 10417563 · XLogP 1.2 · TPSA 258 Ų · H-bond donors 7
XLogP
1.2
TPSA
258 Ų
H-bond donors
7
H-bond acceptors
11
Rotatable bonds
10
Heavy atoms
50

SMILES CC(C)C[C@H]1C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N2CCC[C@H]2C(=O)N[C@H](C(=O)N1)CCSC)C(C)C)CC3=CC=C(C=C3)OP(=O)(O)O

Computed descriptors from PubChem (CID 10417563), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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