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CGGRGD

CAT: 0804-HY-P2219-02Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-P2219-02Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
CGGRGD, a RGD derivative with cysteine as its N-terminal[1].
CAS Number
1260223-44-6
UNSPSC
12352209
Target
Amino Acid Derivatives
Type
Peptides
Related Pathways
Others
Applications
Cancer-programmed cell death
Field of Research
Cancer
Assay Protocol
https://www.medchemexpress.com/cggrgd.html
Solubility
10 mM in DMSO
Smiles
O=C(O)C[C@@H](C(O)=O)NC(CNC([C@H](CCCNC(N)=N)NC(CNC(CNC([C@H](CS)N)=O)=O)=O)=O)=O
Molecular Formula
C19H33N9O9S
Molecular Weight
563.59
References & Citations
[1]Wenting Zhen, et al.Functionalization of PCL fibrous membrane with RGD peptide
Shipping Conditions
Room temperature
Scientific Category
Peptides
Clinical Information
No Development Reported

Chemical Information

Cggrgd
CAS Number1260223-44-6
PubChem CID146014794
IUPAC Name(2S)-2-[[2-[[(2S)-2-[[2-[[2-[[(2R)-2-amino-3-sulfanylpropanoyl]amino]acetyl]amino]acetyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]acetyl]amino]butanedioic acid
Molecular FormulaC19H33N9O9S
Molecular Weight563.6
XLogP-7.6
Topological Polar Surface Area312
Hydrogen Bond Donor Count11
Hydrogen Bond Acceptor Count12
Rotatable Bond Count18
Heavy Atom Count38
Formal Charge0
Complexity912
SMILES
C(C[C@@H](C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)O)NC(=O)CNC(=O)CNC(=O)[C@H](CS)N)CN=C(N)N
InChI
InChI=1S/C19H33N9O9S/c20-9(8-38)16(34)25-5-12(29)24-6-13(30)27-10(2-1-3-23-19(21)22)17(35)26-7-14(31)28-11(18(36)37)4-15(32)33/h9-11,38H,1-8,20H2,(H,24,29)(H,25,34)(H,26,35)(H,27,30)(H,28,31)(H,32,33)(H,36,37)(H4,21,22,23)/t9-,10-,11-/m0/s1
InChIKey
JOAINURLILLAIC-DCAQKATOSA-N
Chemical Structure
2D Structure
2D structure of Cggrgd
CAS: 1260223-44-6
CID: 146014794
Formula: C19H33N9O9S
MW: 563.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight563.6
XLogP3-7.6
Hydrogen Bond Donor Count11
Hydrogen Bond Acceptor Count12
Rotatable Bond Count18
Exact Mass563.21219484
Monoisotopic Mass563.21219484
Topological Polar Surface Area312 Ų
Heavy Atom Count38
Formal Charge0
Complexity912
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
M30395CGGRGD
GTR19144219-01CGGRGD TFA
MBS5789377CGGRGD TFA (1260223-44-6 free base)
BUP04209-01CGGRGD acetate (1260223-44-6 free base)

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