EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:218576 - Alterochromide A'

ChEBI IDCHEBI:218576
ChEBI NameAlterochromide A'
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC38H51N7O10
Net Charge0
Average Mass765.865
Monoisotopic Mass765.36974
SMILESCC(C)C[C@@H]1NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)/C=C/C=C/C=C/C=C/c2ccc(O)cc2)[C@@H](C)OC1=O
InChIInChI=1S/C38H51N7O10/c1-21(2)18-28-38(54)55-23(5)33(44-31(49)13-11-9-7-6-8-10-12-24-14-16-25(46)17-15-24)37(53)45-32(22(3)4)36(52)42-27(20-30(40)48)34(50)41-26(19-29(39)47)35(51)43-28/h6-17,21-23,26-28,32-33,46H,18-20H2,1-5H3,(H2,39,47)(H2,40,48)(H,41,50)(H,42,52)(H,43,51)(H,44,49)(H,45,53)/b8-6+,9-7+,12-10+,13-11+/t23-,26+,27+,28+,32+,33+/m1/s1
InChIKeyOWKXPRGJANXGFA-GSBAQSCKSA-N
Species of MetaboliteComponentSourceComments
Pseudoalteromonas piscicida ATCC 15057 (ncbitaxon:1279016) - PubMed (25140825)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Alterochromide A' (CHEBI:218576) is a cyclodepsipeptide (CHEBI:35213)
IUPAC Name 
(2E,4E,6E,8E)-N-[(3S,6S,9S,12S,15S,16R)-6,9-bis(2-amino-2-oxoethyl)-16-methyl-3-(2-methylpropyl)-2,5,8,11,14-pentaoxo-12-propan-2-yl-1-oxa-4,7,10,13-tetrazacyclohexadec-15-yl]-9-(4-hydroxyphenyl)nona-2,4,6,8-tetraenamide
Manual XrefsDatabases
78442809ChemSpider