EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:222044 - Pseudovibriamide B6

ChEBI IDCHEBI:222044
ChEBI NamePseudovibriamide B6
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC52H73N13O15S
Net Charge0
Average Mass1152.299
Monoisotopic Mass1151.50698
SMILESC/C=C(/C(=O)N[C@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@H]1c1nc(C(=O)N[C@@H](CCC(N)=O)C(=O)OC(CC(=O)O)C2C(OC(=O)CC)CCN2C(=O)[C@@H](N)CC(C)C)cs1)N1C(=O)N[C@@H](Cc2ccc(O)cc2)C1=O
InChIInChI=1S/C52H73N13O15S/c1-6-35(65-49(76)33(62-52(65)78)23-28-12-14-29(66)15-13-28)45(73)58-27(5)43(71)59-31(10-8-19-57-51(55)56)48(75)63-20-9-11-36(63)46-61-34(25-81-46)44(72)60-32(16-17-39(54)67)50(77)80-38(24-40(68)69)42-37(79-41(70)7-2)18-21-64(42)47(74)30(53)22-26(3)4/h6,12-15,25-27,30-33,36-38,42,66H,7-11,16-24,53H2,1-5H3,(H2,54,67)(H,58,73)(H,59,71)(H,60,72)(H,62,78)(H,68,69)(H4,55,56,57)/b35-6-/t27-,30+,31+,32+,33+,36+,37?,38?,42?/m1/s1
InChIKeyDOSZVMSUCGKVPG-SGVYKYBRSA-N
Species of MetaboliteComponentSourceComments
Pseudovibrio (ncbitaxon:258255) - PubMed (33961724)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Pseudovibriamide B6 (CHEBI:222044) is a depsipeptide (CHEBI:23643)