Arginyl-hydroxyprolyl-prolyl-glycyl-(2-thienyl)alanyl-seryl-phenylalanyl-2-(thienyl)alanyl-arginine

Basic Information

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CAS Number

103412-36-8

Molecular Formula

C56H83N19O13S2

Molecular Weight

1294.53 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Amines

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

SMILES

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C1CC(N(C1)C(=O)C2CC(CN2C(=O)C(CCCN=C(N)N)NC(=O)C(CCCN=C(N)N)N)O)C(=O)NCC(=O)NC(CC3=CC=CS3)C(=O)NC(CO)C(=O)NC(CC4=CC=CC=C4)C(=O)NC(CC5=CC=CS5)C(=O)NC(CCCN=C(N)N)C(=O)O

InChI

InChI=1S/C56H83N19O13S2/c57-35(14-4-18-64-54(58)59)45(79)69-36(15-5-19-65-55(60)61)51(85)75-29-32(77)25-43(75)52(86)74-21-7-17-42(74)50(84)67-28-44(78)68-39(26-33-12-8-22-89-33)47(81)73-41(30-76)49(83)71-38(24-31-10-2-1-3-11-31)46(80)72-40(27-34-13-9-23-90-34)48(82)70-37(53(87)88)16-6-20-66-56(62)63/h1-3,8-13,22-23,32,35-43,76-77H,4-7,14-21,24-30,57H2,(H,67,84)(H,68,78)(H,69,79)(H,70,82)(H,71,83)(H,72,80)(H,73,81)(H,87,88)(H4,58,59,64)(H4,60,61,65)(H4,62,63,66)/t32-,35-,36+,37+,38-,39+,40+,41+,42+,43+/m1/s1

InChIKey

ULGMPJSHNJQEJC-VDMFLOONSA-N

LogP

-5.619700000000026

Topological Polar Surface Area

541.2999999999998 Å²

Hydrogen Bond Donor/Acceptor

24 / 32

Complexity

2540

Synonyms & References

English

N~5~-(diaminomethylidene)-D-ornithyl-N~5~-(diaminomethylidene)-L-ornithyl-(4R)-4-hydroxy-L-prolyl-L-prolylglycyl-3-(thiophen-2-yl)-L-alanyl-L-seryl-D-phenylalanyl-3-(thiophen-2-yl)-L-alanyl-N~5~-(diaminomethylidene)-L-ornithine
LogP
(D-Arg?00O-Hyp?00β-(2-thienyl)-Ala?·?00D-Phe?)-Bradykinin
(D-Arg0,Hyp3,β-(2-thienyl)-Ala5?8,D-Phe7)-Bradykinin
(D-Arg⁰,Hyp³,β-(2-thienyl)-Ala⁵·⁸,D-Phe⁷)-Bradykinin
H-D-ARG-ARG-PRO-HYP-GLY-B-(2-THIENYL)-ALA-SER-D-PHE-B-(2-THIENYL)-ALA-ARG-OH
HOE k86-4321
N~5~-(diaminomethylidene)-D-ornithyl-N~5~-(diaminomethylidene)-L-ornithyl-(4R)-4-hydroxy-L-prolyl-L-prolylglycyl-3-(thiophen-
N~5~-(diaminomethylidene)-D-ornithyl-N~5~-(diaminomethylidene)-L-ornithyl-(4R)-4-hydroxy-L-prolyl-L-prolylglycyl-3-(thiophen-2-yl)-L-alanyl-L-seryl-D-phenylalanyl-3-(thiophen-2-yl)-L-alanyl-N~5~-(diam
B 3816
B4307, Hoe k86-4321, Ahtp-BK
(D-Arg0,Hyp3,b-(2-thienyl)-Ala5·8,D-Phe7)-Bradykinin
Arginyl-hydroxyprolyl-prolyl-glycyl-(2-thienyl)alanyl-seryl-phenylalanyl-2-(thienyl)alanyl-arginine
Ahtp-BK
Bradykinin, arg-hyp(2)-(thi-ala)(5,8)-phe(7)-
Arg-hyp-pro-gly-thi-ser-phe-thi-arg
2-Hyp-5,8-(thi-ala)-7-phe-bradykinin
Bradykinin, hydroxyprolyl(2)-thienylalanyl(5,8)-phenylalanine(7)-
1-Arginyl-2-hydroxyprolyl-5-(2-thienyl)alanyl-7-phenylalanyl-8-(2-thienyl)alanyl-bradykinin
(D-Arg0,Hyp3,
A-(2-thienyl)-Ala5.8,D-Phe7)-Bradyk
Hoe-k86-4321
Hoe k86-4321
DTXSID80145822
L-Arginine, N2-(N-(N-(N-(N-(N-(1-(1-(N2-D-arginyl-L-arginyl)-trans-4-hydroxy-L-prolyl)-L-prolyl)glycyl)-3-(2-thienyl)-L-alanyl)-L-seryl)-D-phenylalanyl)-3-(2-thienyl)-L-alanyl)-
A-(2-thienyl)-Ala5.8,D-Phe7)-Bradykinin
103412-36-8