CHEBI:80127 - Angiotensin IV

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Angiotensin IV
ChEBI ID CHEBI:80127
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C40H54N8O8
Net Charge 0
Average Mass 774.907
Monoisotopic Mass 774.40646
InChI InChI=1S/C40H54N8O8/c1-5-24(4)34(47-35(50)29(44-37(52)33(41)23(2)3)18-26-13-15-28(49)16-14-26)38(53)45-30(20-27-21-42-22-43-27)39(54)48-17-9-12-32(48)36(51)46-31(40(55)56)19-25-10-7-6-8-11-25/h6-8,10-11,13-16,21-24,29-34,49H,5,9,12,17-20,41H2,1-4H3,(H,42,43)(H,44,52)(H,45,53)(H,46,51)(H,47,50)(H,55,56)/t24-,29-,30-,31-,32-,33-,34-/m0/s1
InChIKey QSBGWDDCOJYQGY-KOQODJNWSA-N
SMILES [C@@H]1(N(CCC1)C([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](N)C(C)C)=O)CC2=CC=C(C=C2)O)=O)[C@H](CC)C)=O)CC3=CN=CN3)=O)C(N[C@@H](CC4=CC=CC=C4)C(O)=O)=O
ChEBI Ontology
Outgoing Angiotensin IV (CHEBI:80127) is a organic molecular entity (CHEBI:50860)
Synonym Source
Angiotensin II, 1-des-asn-2-arg KEGG COMPOUND
Manual Xrefs Databases
C15849 KEGG COMPOUND
HMDB0001038 HMDB
View more database links
Registry Number Type Source
12676-15-2 CAS Registry Number KEGG COMPOUND
Last Modified
16 August 2018