angiotensin I   Click here for help

GtoPdb Ligand ID: 583

Synonyms: ang I
Comment: As is the case with many peptide molecules, there is some ambiguity surrounding the stereochemistry of angiotensin I, therefore the chemical structure shown here may differ slightly from that shown on other resources.
Species: Human, Mouse, Rat
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2D Structure
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Canonical SMILES CCC(C(C(=O)NC(C(=O)N1CCCC1C(=O)NC(C(=O)NC(C(=O)C(C(C(=O)C)CC(C)C)N)Cc1cnc[nH]1)Cc1ccccc1)Cc1cnc[nH]1)NC(=O)C(c1ccc(cc1)O)NCC(C(C)C)NC(=O)C(NC(=O)C(CC(=O)O)N)CCCN=C(N)N)C
Isomeric SMILES CCC(C(C(=O)NC(C(=O)N1CCCC1C(=O)NC(C(=O)NC(C(=O)C(C(C(=O)C)CC(C)C)N)Cc1cnc[nH]1)Cc1ccccc1)Cc1cnc[nH]1)NC(=O)C(c1ccc(cc1)O)NCC(C(C)C)NC(=O)C(NC(=O)C(CC(=O)O)N)CCCN=C(N)N)C
InChI InChI=1S/C63H93N17O12/c1-8-36(6)53(79-61(91)54(39-18-20-42(82)21-19-39)71-31-49(35(4)5)78-57(87)45(16-12-22-70-63(66)67)74-56(86)44(64)28-51(83)84)60(90)77-48(27-41-30-69-33-73-41)62(92)80-23-13-17-50(80)59(89)76-47(25-38-14-10-9-11-15-38)58(88)75-46(26-40-29-68-32-72-40)55(85)52(65)43(37(7)81)24-34(2)3/h9-11,14-15,18-21,29-30,32-36,43-50,52-54,71,82H,8,12-13,16-17,22-28,31,64-65H2,1-7H3,(H,68,72)(H,69,73)(H,74,86)(H,75,88)(H,76,89)(H,77,90)(H,78,87)(H,79,91)(H,83,84)(H4,66,67,70)
Classification Click here for help
Compound class Endogenous peptide in human, mouse or rat
Ligand families/groups Neuropeptides
Synonyms Click here for help
ang I
Gene/Precursor Click here for help
Gene symbol Gene name Species Precursor protein name Synonyms
AGT angiotensinogen Human Angiotensinogen alpha-1 antiproteinase, antitrypsin, angiotensinogen (serpin peptidase inhibitor, clade A, member 8), SERPINA8
Agt angiotensinogen Mouse Angiotensinogen angiotensinogen (serpin peptidase inhibitor, angiotensinogen (serpin peptidase inhibitor, clade A, member 8), angiotensin precursor, Aogen, Serpina8
Agt angiotensinogen Rat Angiotensinogen Ang, AngII, angiotensin II, angiotensinogen, angiotensinogen (PAT), angiotensinogen (serpin peptidase inhibitor, clade A, member 8), ANRT, MGC105326, PAT, serpin A8
Database Links Click here for help
BindingDB Ligand 50048131
CAS Registry No. 484-42-4
Ensembl Gene ENSG00000135744 (Hs), ENSMUSG00000031980 (Mm), ENSRNOG00000018445 (Rn)
GtoPdb PubChem SID 135651615
Human Protein Atlas ENSG00000135744 (Hs)
PubChem CID 44299732
Search Google for chemical match using the InChIKey AZSXKTYFSLKNEF-UHFFFAOYSA-N
Search Google for chemicals with the same backbone AZSXKTYFSLKNEF
UniChem Compound Search for chemical match using the InChIKey AZSXKTYFSLKNEF-UHFFFAOYSA-N
UniChem Connectivity Search for chemical match using the InChIKey AZSXKTYFSLKNEF-UHFFFAOYSA-N
UniProtKB P01015 (Rn), P11859 (Mm), P01019 (Hs)
Wikipedia Angiotensin#Angiotensin_I