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Plactin C

CAT: 0013-GTR19255455-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19255455-01Size:50 mg
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Description
Plactin C is a cyclic pentapeptide compound that enhances the dissolution of fibrinolytic proteins.
CAS Number
174689-43-1
Smiles
C ([C@@H]1NC (=O) [C@@] ([C@H] (CC) C) (NC (=O) [C@H] (CC (C) C) NC (=O) [C@@H] (C (C) C) NC (=O) [C@@H] (CCCNC (=N) N) NC1=O) [H]) C2=CC=CC=C2
Molecular Formula
C32H52N8O5
Molecular Weight
628.81
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

cyclo(-D-Val-L-Leu-D-alloIle-L-Phe-D-Arg-)
CAS Number174689-43-1
PubChem CID10326645
IUPAC Name2-[3-[(2R,5R,8S,11R,14S)-14-benzyl-11-[(2S)-butan-2-yl]-8-(2-methylpropyl)-3,6,9,12,15-pentaoxo-5-propan-2-yl-1,4,7,10,13-pentazacyclopentadec-2-yl]propyl]guanidine
Molecular FormulaC32H52N8O5
Molecular Weight628.8
XLogP2.7
Topological Polar Surface Area210
Hydrogen Bond Donor Count7
Hydrogen Bond Acceptor Count6
Rotatable Bond Count11
Heavy Atom Count45
Formal Charge0
Complexity1040
SMILES
CC[C@H](C)[C@@H]1C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N1)CC(C)C)C(C)C)CCCN=C(N)N)CC2=CC=CC=C2
InChI
InChI=1S/C32H52N8O5/c1-7-20(6)26-31(45)38-24(17-21-12-9-8-10-13-21)28(42)36-22(14-11-15-35-32(33)34)27(41)39-25(19(4)5)30(44)37-23(16-18(2)3)29(43)40-26/h8-10,12-13,18-20,22-26H,7,11,14-17H2,1-6H3,(H,36,42)(H,37,44)(H,38,45)(H,39,41)(H,40,43)(H4,33,34,35)/t20-,22+,23-,24-,25+,26+/m0/s1
InChIKey
NCNJIICILCDYSW-YFKNHNIXSA-N
Chemical Structure
2D Structure
2D structure of cyclo(-D-Val-L-Leu-D-alloIle-L-Phe-D-Arg-)
CAS: 174689-43-1
CID: 10326645
Formula: C32H52N8O5
MW: 628.8
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight628.8
XLogP32.7
Hydrogen Bond Donor Count7
Hydrogen Bond Acceptor Count6
Rotatable Bond Count11
Exact Mass628.40606679
Monoisotopic Mass628.40606679
Topological Polar Surface Area210 Ų
Heavy Atom Count45
Formal Charge0
Complexity1040
Isotope Atom Count0
Defined Atom Stereocenter Count6
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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