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CHEBI:34541 - Argiotoxin 636

Default Structure
ChEBI IDCHEBI:34541
ChEBI NameArgiotoxin 636
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC29H52N10O6
Net Charge0
Average Mass636.799
Monoisotopic Mass636.40713
SMILESN=C(N)NCCC[C@H](N)C(=O)NCCCNCCCNCCCCCNC(=O)[C@H](CC(N)=O)NC(=O)Cc1ccc(O)cc1O
InChIInChI=1S/C29H52N10O6/c30-22(7-4-15-38-29(32)33)27(44)36-16-6-13-35-12-5-11-34-10-2-1-3-14-37-28(45)23(19-25(31)42)39-26(43)17-20-8-9-21(40)18-24(20)41/h8-9,18,22-23,34-35,40-41H,1-7,10-17,19,30H2,(H2,31,42)(H,36,44)(H,37,45)(H,39,43)(H4,32,33,38)/t22-,23-/m0/s1
InChIKeyFTNICLJXPYLDAH-GOTSBHOMSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Argiotoxin 636 (CHEBI:34541) is a N-acyl-amino acid (CHEBI:51569)
Synonyms  Source
ArgiopinKEGG COMPOUND
Argiotoxin 636KEGG COMPOUND
Manual XrefsDatabases
C13927KEGG COMPOUND
Registry NumbersSources
CAS:108687-79-2KEGG COMPOUND