Drug Information

Drug General Information

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Drug ID

D0X0BI

Former ID

DNC004606

Drug Name

BRADYKININ

Synonyms

BRADYKININ; Kallidin I; 58-82-2; L-Bradykinin; Synthetic bradykinin; Bradykinin (synthetic); Callidin I; UNII-S8TIM42R2W; Kallidin 9; BRS 640; PRS 640; S8TIM42R2W; CHEBI:3165; CHEMBL406291; Bradykinin, Lysyl; BK; Arg-Pro-Pro-Gly-Phe-Ser-Pro-Phe-Arg; EINECS 200-398-8; L-arginyl-L-prolyl-L-prolylglycyl-L-phenylalanyl-L-seryl-L-prolyl-L-phenylalanyl-L-arginine

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Drug Type

Small molecular drug

Structure

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2D MOL

3D MOL

Formula

C50H73N15O11

Canonical SMILES

C1CC(N(C1)C(=O)C2CCCN2C(=O)C(CCCN=C(N)N)N)C(=O)NCC(=O)NC(CC3=CC=CC=C3)C(=O)NC(CO)C(=O)N4CCCC4C(=O)NC(CC5=CC=CC=C5)C(=O)NC(CCCN=C(N)N)C(=O)O

InChI

1S/C50H73N15O11/c51-32(16-7-21-56-49(52)53)45(72)65-25-11-20-39(65)47(74)64-24-9-18-37(64)43(70)58-28-40(67)59-34(26-30-12-3-1-4-13-30)41(68)62-36(29-66)46(73)63-23-10-19-38(63)44(71)61-35(27-31-14-5-2-6-15-31)42(69)60-33(48(75)76)17-8-22-57-50(54)55/h1-6,12-15,32-39,66H,7-11,16-29,51H2,(H,58,70)(H,59,67)(H,60,69)(H,61,71)(H,62,68)(H,75,76)(H4,52,53,56)(H4,54,55,57)/t32-,33-,34-,35-,36-,37-,38-,39-/m0/s1

InChIKey

QXZGBUJJYSLZLT-FDISYFBBSA-N

CAS Number

CAS 58-82-2

PubChem Compound ID

439201

PubChem Substance ID

3600, 841468, 3139670, 7978810, 15090019, 36883455, 50112435, 50849217, 53789586, 91689969, 93581329, 103279772, 103980149, 104619886, 126525053, 134341811, 135651637, 137019791, 137255716, 137275542, 162220561, 164779222, 184605781, 198973777, 224949119, 229099223, 241108945, 241376207, 247680280, 249727084, 252156939

ChEBI ID

CHEBI:3165

Target and Pathway

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Target(s)

B2 bradykinin receptor (BDKRB2)

Target Info

Inhibitor

[1]

KEGG Pathway

Calcium signaling pathway

cGMP-PKG signaling pathway