EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:68404 - Mirabamide F

Default Structure
ChEBI IDCHEBI:68404
ChEBI NameMirabamide F
Stars
DefinitionA natural product found in Stelletta clavosa.
DownloadsMolfile
FormulaC72H112ClN13O23
Net Charge0
Average Mass1563.209
Monoisotopic Mass1561.76825
SMILESC/C=C(\NC(=O)CNC(=O)C(C)C(O)/C=C\C(C)=C\C(C)CC)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H]1C(=O)N[C@H](COC)C(=O)NCC(=O)N[C@@H](C)C(=O)N(C)[C@@H]([C@@H](C)O)C(=O)N[C@H]([C@H](OC)c2ccc(O[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)cc2)C(=O)N2CC[C@H](Cl)C[C@H]2C(=O)O[C@@H]1C(C)C)[C@@H](C)[C@@H](C)C(N)=O)[C@H](C)N
InChIInChI=1S/C72H112ClN13O23/c1-17-33(5)27-34(6)19-24-48(88)37(9)62(95)76-30-50(90)79-45(18-2)64(97)82-52(38(10)74)66(99)81-51(35(7)36(8)61(75)94)65(98)83-53-59(32(3)4)109-71(104)47-28-43(73)25-26-86(47)70(103)54(60(106-16)42-20-22-44(23-21-42)108-72-58(93)57(92)56(91)41(13)107-72)84-68(101)55(40(12)87)85(14)69(102)39(11)78-49(89)29-77-63(96)46(31-105-15)80-67(53)100/h18-24,27,32-33,35-41,43,46-48,51-60,72,87-88,91-93H,17,25-26,28-31,74H2,1-16H3,(H2,75,94)(H,76,95)(H,77,96)(H,78,89)(H,79,90)(H,80,100)(H,81,99)(H,82,97)(H,83,98)(H,84,101)/b24-19-,34-27+,45-18-/t33?,35-,36+,37?,38-,39-,40+,41-,43-,46+,47-,48?,51-,52-,53+,54+,55-,56-,57+,58+,59+,60+,72-/m0/s1
InChIKeyFMEFONVJOKEKCD-FKSYTPMBSA-N
Species of MetaboliteComponentSourceComments
Stelletta clavosa (WORMS:169915) - PubMed (21280591) Methanolic extract of frozen sponge
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
Mirabamide F (CHEBI:68404) has role metabolite (CHEBI:25212)
Mirabamide F (CHEBI:68404) is a organic molecular entity (CHEBI:50860)
Citations