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MOCAc-Pro-Leu-Gly

CAT: 0926-MOC-3164-SSize: 0.1 mgDry Ice: NoHazardous: No
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CAT#:0926-MOC-3164-SSize:0.1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
140430-56-4
Synonyms
(7-Methoxycoumarin-4-yl) acetyl-L-Prolyl-L-Leucyl-Glycine; Mca-Pro-Leu-Gly-OH
Smiles
CC (C) CC (C (=O) NCC (=O) O) NC (=O) C1CCCN1C (=O) CC2=CC (=O) OC3=C2C=CC (=C3) OC
Molecular Formula
C25H31N3O8
Molecular Weight
501.53 g/mol
Controlled
No

Chemical Information

2-[[2-[[1-[2-(7-Methoxy-2-oxochromen-4-yl)acetyl]pyrrolidine-2-carbonyl]amino]-4-methylpentanoyl]amino]acetic acid
CAS Number140430-56-4
PubChem CID4336829
IUPAC Name2-[[2-[[1-[2-(7-methoxy-2-oxochromen-4-yl)acetyl]pyrrolidine-2-carbonyl]amino]-4-methylpentanoyl]amino]acetic acid
Molecular FormulaC25H31N3O8
Molecular Weight501.5
XLogP1.4
Topological Polar Surface Area151
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count8
Rotatable Bond Count10
Heavy Atom Count36
Formal Charge0
Complexity902
SMILES
CC(C)CC(C(=O)NCC(=O)O)NC(=O)C1CCCN1C(=O)CC2=CC(=O)OC3=C2C=CC(=C3)OC
InChI
InChI=1S/C25H31N3O8/c1-14(2)9-18(24(33)26-13-22(30)31)27-25(34)19-5-4-8-28(19)21(29)10-15-11-23(32)36-20-12-16(35-3)6-7-17(15)20/h6-7,11-12,14,18-19H,4-5,8-10,13H2,1-3H3,(H,26,33)(H,27,34)(H,30,31)
InChIKey
IIEDBZTWPBXMRN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-[[2-[[1-[2-(7-Methoxy-2-oxochromen-4-yl)acetyl]pyrrolidine-2-carbonyl]amino]-4-methylpentanoyl]amino]acetic acid
CAS: 140430-56-4
CID: 4336829
Formula: C25H31N3O8
MW: 501.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight501.5
XLogP31.4
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count8
Rotatable Bond Count10
Exact Mass501.21111496
Monoisotopic Mass501.21111496
Topological Polar Surface Area151 Ų
Heavy Atom Count36
Formal Charge0
Complexity902
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
MBS406390-01MOCAc-Pro-Leu-Gly
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MBS406363-01MOCAc-Lys-Pro-Leu-Gly-Leu-Dap(Dnp)-Ala-Arg-NH2
MBS406280-01MOCAc-Lys-Pro-Leu-Gly-Leu-A2pr(Dnp)-Ala-Arg-NH2
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3029-01Z-Gly-Pro-Leu-Gly-Pro
MBS405549-01Z-Gly-Pro-Leu-Gly
4003958.0025Suc-Gly-Pro-Leu-Gly-Pro-AMC
M-1265.0500Z-Gly-Pro-Leu-Gly-Pro-OH

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