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CHEBI:218586 - Alterochromide B

ChEBI IDCHEBI:218586
ChEBI NameAlterochromide B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC40H53N7O10
Net Charge0
Average Mass791.903
Monoisotopic Mass791.38539
SMILESCC[C@@H](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/C=C/c2ccc(O)cc2)[C@@H](C)OC1=O
InChIInChI=1S/C40H53N7O10/c1-6-24(4)34-40(56)57-25(5)35(45-32(51)16-14-12-10-8-7-9-11-13-15-26-17-19-27(48)20-18-26)39(55)46-33(23(2)3)38(54)44-28(21-30(41)49)36(52)43-29(22-31(42)50)37(53)47-34/h7-20,23-25,28-29,33-35,48H,6,21-22H2,1-5H3,(H2,41,49)(H2,42,50)(H,43,52)(H,44,54)(H,45,51)(H,46,55)(H,47,53)/b8-7+,11-9+,12-10+,15-13+,16-14+/t24-,25-,28+,29+,33+,34+,35+/m1/s1
InChIKeyNRENFEWSRZCNTG-UIRCOVLUSA-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 B (CHEBI:218586) is a cyclodepsipeptide (CHEBI:35213)
IUPAC Name 
(2E,4E,6E,8E,10E)-N-[(3S,6S,9S,12S,15S,16R)-6,9-bis(2-amino-2-oxoethyl)-3-[(2R)-butan-2-yl]-16-methyl-2,5,8,11,14-pentaoxo-12-propan-2-yl-1-oxa-4,7,10,13-tetrazacyclohexadec-15-yl]-11-(4-hydroxyphenyl)undeca-2,4,6,8,10-pentaenamide
Manual XrefsDatabases
78442811ChemSpider