TRP-601

CAT: 0013-GTR19200534Size: 25 mgDry Ice: NoHazardous: No

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CAT#:0013-GTR19200534Size:25 mg

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

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Description

TRP-601 is a small molecule caspase inhibitor used in biochemical research. It is applied in both in vitro and in vivo studies to investigate apoptosis pathways, cellular death mechanisms, and related disease models such as neurodegeneration and ischemia-reperfusion injury.

CAS Number

1094569-02-4

Field of Research

Cell Biology, Protein Biochemistry

Smiles

COC (=O) CC (NC (=O) [C@H] (C) NC (=O) [C@@H] (NC (=O) [C@H] (CC (=O) OC) NC (=O) [C@@H] (NC (=O) c1ccc2ccccc2n1) C (C) C) C (C) C) C (=O) COc1c (F) cccc1F |@:41|

Molecular Formula

C40H48F2N6O11

Molecular Weight

826.852

Storage Conditions

-20°C

Notes

For research use only.

Chemical Information

Trp-601

CAS Number	1094569-02-4
PubChem CID	25230346
IUPAC Name	methyl 5-(2,6-difluorophenoxy)-3-[[(2S)-2-[[(2S)-2-[[(2S)-4-methoxy-2-[[(2S)-3-methyl-2-(quinoline-2-carbonylamino)butanoyl]amino]-4-oxobutanoyl]amino]-3-methylbutanoyl]amino]propanoyl]amino]-4-oxopentanoate
Molecular Formula	C40H48F2N6O11
Molecular Weight	826.8
XLogP	3.7
Topological Polar Surface Area	237
Hydrogen Bond Donor Count	5
Hydrogen Bond Acceptor Count	14
Rotatable Bond Count	22
Heavy Atom Count	59
Formal Charge	0
Complexity	1490

SMILES

C[C@@H](C(=O)NC(CC(=O)OC)C(=O)COC1=C(C=CC=C1F)F)NC(=O)[C@H](C(C)C)NC(=O)[C@H](CC(=O)OC)NC(=O)[C@H](C(C)C)NC(=O)C2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C40H48F2N6O11/c1-20(2)33(39(55)43-22(5)36(52)45-28(17-31(50)57-6)30(49)19-59-35-24(41)12-10-13-25(35)42)48-38(54)29(18-32(51)58-7)46-40(56)34(21(3)4)47-37(53)27-16-15-23-11-8-9-14-26(23)44-27/h8-16,20-22,28-29,33-34H,17-19H2,1-7H3,(H,43,55)(H,45,52)(H,46,56)(H,47,53)(H,48,54)/t22-,28?,29-,33-,34-/m0/s1

InChIKey

UKOOXNFTVLKWED-HRNCDAKQSA-N

Chemical Structure

2D Structure

CAS: 1094569-02-4

CID: 25230346

Formula: C40H48F2N6O11

MW: 826.8

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	826.8
XLogP3	3.7
Hydrogen Bond Donor Count	5
Hydrogen Bond Acceptor Count	14
Rotatable Bond Count	22
Exact Mass	826.33491269
Monoisotopic Mass	826.33491269
Topological Polar Surface Area	237 Å²
Heavy Atom Count	59
Formal Charge	0
Complexity	1490
Isotope Atom Count	0
Defined Atom Stereocenter Count	4
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Related Products

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GTR19281260-01	RED-601
GTR19203074-01	SPK-601
GTR19231510-01	Ono EI-601
GTR19275384-01	CRBN ligand-601
GTR19035896-01	H-Trp-Trp-Trp-OH
GTR19200171-01	JTH-601 free base
GTR17698191	MON1A (aa589-601) Antibody

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Catalog	Name
HY-P2012	TRP-601
T29499-01	A 601
T12771-01	RS-601
ARC0875	SNU-601
MBS3600375-01	SPK-601
sc-66063	Lidocaine (601)
HY-110065-01	SER-601
MBS579691	ASL 601
T31559-01	DO-601
sc-296379A	SER 601

TRP-601

Chemical Information

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