EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:221333 - Emerimicin V

ChEBI IDCHEBI:221333
ChEBI NameEmerimicin V
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC78H122N16O19
Net Charge0
Average Mass1587.927
Monoisotopic Mass1586.90722
SMILESCC[C@@](C)(NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@](C)(CC)NC(=O)C(C)(C)NC(=O)C(C)(C)NC(=O)C(C)(C)NC(=O)[C@H](Cc1ccccc1)NC(C)=O)C(=O)NC(C)(C)C(=O)N1C[C@H](O)C[C@H]1C(=O)NC(CCC(N)=O)C(=O)N[C@](C)(CC)C(=O)N1C[C@H](O)C[C@H]1C(=O)NC(C)(C)C(=O)N[C@H](CO)Cc1ccccc1
InChIInChI=1S/C78H122N16O19/c1-20-76(17,92-66(109)74(13,14)90-65(108)73(11,12)89-64(107)72(9,10)85-59(102)53(81-45(6)96)37-47-31-27-24-28-32-47)67(110)80-40-57(100)83-52(35-44(4)5)60(103)87-77(18,21-2)68(111)91-75(15,16)69(112)93-41-49(97)38-54(93)61(104)84-51(33-34-56(79)99)58(101)88-78(19,22-3)70(113)94-42-50(98)39-55(94)62(105)86-71(7,8)63(106)82-48(43-95)36-46-29-25-23-26-30-46/h23-32,44,48-55,95,97-98H,20-22,33-43H2,1-19H3,(H2,79,99)(H,80,110)(H,81,96)(H,82,106)(H,83,100)(H,84,104)(H,85,102)(H,86,105)(H,87,103)(H,88,101)(H,89,107)(H,90,108)(H,91,111)(H,92,109)/t48-,49+,50+,51?,52-,53-,54-,55-,76+,77+,78+/m0/s1
InChIKeyCYIGOEDJHMTHPD-KWSUPYHSSA-N
Species of MetaboliteComponentSourceComments
Acremonium (ncbitaxon:159075) - PubMed (33617244)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Emerimicin V (CHEBI:221333) is a oligopeptide (CHEBI:25676)