Research chemical
Cyclo(-RGDfK) Trifluoroacetate
CAS Number: 500577-51-5
Product details
Identity & specification
- Molecular formula
- C29H42F3N9O9
- Molecular weight
- 717.7 g/mol
- Product type
- Research-use catalog compound
- Documentation
- COA / SDS available by request
For laboratory research and professional procurement workflows.
Technical identifiers
Show PubChem, InChIKey, IUPAC, and SMILES
PubChem CID
91759592
Exact Mass
717.305758
InChIKey
WHCQIPJAWCYHFT-HXSCNMCGSA-N
IUPAC Name
2-[(2S,5R,8S,11S)-8-(4-aminobutyl)-5-benzyl-11-[3-(diaminomethylideneamino)propyl]-3,6,9,12,15-pentaoxo-1,4,7,10,13-pentazacyclopentadec-2-yl]acetic acid;2,2,2-trifluoroacetic acid
SMILES String
N=C(N)NCCC[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](CC(=O)O)NC(=O)CNC1=O.O=C(O)C(F)(F)F
Physical Properties
No physical property values available.
Properties are provided as catalog reference data and may be confirmed through supplier documentation when required.
Computed Structure Descriptors
Show calculated structure fields
Heavy atom count
50
H-bond acceptors
18
H-bond donors
13
Rotatable bonds
12
Ring count
2
Aromatic rings
1
Topological polar surface area
308.02 Ų
Computed LogP
-2.2
Fragment-like structure rule
No
Lead-like structure rule
No
Drug-like structure rule
No
Structure family
n heterocycle ligand
Precious metal motif
No
Transition metal motif
No
Phosphine ligand motif
No
N-heterocycle motif
Yes
Boronic acid motif
No
Computed structure descriptors generated from molecular structure. These are not experimental physical property values, supplier specifications, SDS data, or bioactivity claims.
Catalog Facts
Structural features
Cyclo(-RGDfK) Trifluoroacetate (CAS 500577-51-5) is maintained as a commercial cas reference with formula C29H42F3N9O9, molecular weight 717. 70 g/mol, PubChem CID 91759592.
Sourcing context
Catalog reference for RFQ preparation, supplier confirmation, and research chemical sourcing review.
Research use context
Use this page for CAS identity lookup, internal catalog search, and commercial discovery workflows; structure-derived tags include nitrogen-containing heterocycle.
Documentation needs
Review supplier documentation before handling; for research use only.
Applications & Classification
Safety & Handling
Safety and handling reference content is available through documentation requests.
For supplier-issued SDS, request documentation before handling, storage, shipment, or procurement decisions.
Catalog navigation
Related Catalog Entries
Linked by recorded structural or research relationships, not interchangeable products. Check the exact CAS, specification and availability on the linked product page.
Procurement questions
What are the key identifiers for Cyclo(-RGDfK) Trifluoroacetate (CAS 500577-51-5)?
Cyclo(-RGDfK) Trifluoroacetate is identified by CAS 500577-51-5, with molecular formula C29H42F3N9O9, molecular weight 717.7, InChIKey WHCQIPJAWCYHFT-HXSCNMCGSA-N.
Can I request a COA for CAS 500577-51-5?
Yes. Submit an RFQ and specify COA requirements. Lot-specific COA depends on supplier confirmation.
Can I request supplier SDS for Cyclo(-RGDfK) Trifluoroacetate?
Yes. Supplier SDS can be requested through the RFQ workflow before handling, storage, shipment, or procurement decisions.
Is CAS 500577-51-5 available for quotation?
Availability, pack size, lead time, and pricing are confirmed through RFQ.
Can MolGraph support bulk sourcing or custom synthesis review?
Submit the CAS number, quantity, purity requirement, and destination country for sourcing review.