Angstrom6

CAT: 1568-C06897-02Size: 25 mgDry Ice: NoHazardous: No

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CAT#:1568-C06897-02Size:25 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

220334-14-5

SKU

C06897-5mg

Target

CD markers

Applications

Transmembrane Transporters

Smiles

CC (=O) NC (CCCCN) C (=O) N1CCCC1C (=O) NC (CO) C (=O) NC (CO) C (=O) N2CCCC2C (=O) N3CCCC3C (=O) NC (CCC (O) =O) C (=O) NC (CCC (O) =O) C (N) =O

Molecular Formula

C39H62N10O15

Additionnal Information

Angstrom6 (A6 Peptide) is a capped, eight l-amino acid peptide (Ac-KPSSPPEE-NH2) derived from the biologically active connecting peptide domain of the serine protease, human urokinase plasminogen activator (uPA), which can binds to CD44 resulting in the inhibition of migration, invasion, and metastasis of tumor cells, and the modulation of CD44-mediated cell signaling.

Storage Conditions

3 years-20°C powder

Chemical Information

Angstrom6

CAS Number	220334-14-5
PubChem CID	42638946
IUPAC Name	(4S)-4-[[(2S)-2-[[(2S)-1-[(2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-1-[(2S)-2-acetamido-6-aminohexanoyl]pyrrolidine-2-carbonyl]amino]-3-hydroxypropanoyl]amino]-3-hydroxypropanoyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]amino]-4-carboxybutanoyl]amino]-5-amino-5-oxopentanoic acid
Molecular Formula	C39H62N10O15
Molecular Weight	911.0
XLogP	-7.6
Topological Polar Surface Area	391
Hydrogen Bond Donor Count	11
Hydrogen Bond Acceptor Count	16
Rotatable Bond Count	25
Heavy Atom Count	64
Formal Charge	0
Complexity	1750

SMILES

CC(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N2CCC[C@H]2C(=O)N3CCC[C@H]3C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N

InChI

InChI=1S/C39H62N10O15/c1-21(52)42-24(7-2-3-15-40)37(62)47-16-4-8-27(47)36(61)45-25(19-50)34(59)46-26(20-51)38(63)49-18-6-10-29(49)39(64)48-17-5-9-28(48)35(60)44-23(12-14-31(55)56)33(58)43-22(32(41)57)11-13-30(53)54/h22-29,50-51H,2-20,40H2,1H3,(H2,41,57)(H,42,52)(H,43,58)(H,44,60)(H,45,61)(H,46,59)(H,53,54)(H,55,56)/t22-,23-,24-,25-,26-,27-,28-,29-/m0/s1

InChIKey

NJSODKGEFNFGRI-PJYAFMLMSA-N

Chemical Structure

2D Structure

CAS: 220334-14-5

CID: 42638946

Formula: C39H62N10O15

MW: 911.0

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	911.0
XLogP3	-7.6
Hydrogen Bond Donor Count	11
Hydrogen Bond Acceptor Count	16
Rotatable Bond Count	25
Exact Mass	910.43961131
Monoisotopic Mass	910.43961131
Topological Polar Surface Area	391 Å²
Heavy Atom Count	64
Formal Charge	0
Complexity	1750
Isotope Atom Count	0
Defined Atom Stereocenter Count	8
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Alternative Products

Catalog	Name
MBS3847311-01	Angstrom6
A22731-500	Angstrom6 500mg
A22731-25	Angstrom6 25mg
A22731-10	Angstrom6 10mg
A22731-1	Angstrom6 1mg
A22731-100	Angstrom6 100mg
A22731-50	Angstrom6 50mg
A22731-5	Angstrom6 5mg

Angstrom6

Chemical Information

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