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CHEBI:68403 - Mirabamide E

Default Structure
ChEBI IDCHEBI:68403
ChEBI NameMirabamide E
Stars
DefinitionA natural product found in Stephania cephalantha.
DownloadsMolfile
FormulaC72H112ClN13O24
Net Charge0
Average Mass1579.208
Monoisotopic Mass1577.76317
SMILESC/C=C(\NC(=O)CNC(=O)C(C)(O)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/C72H112ClN13O24/c1-17-33(5)27-34(6)19-24-47(88)72(13,105)71(104)77-30-49(90)79-44(18-2)62(96)82-51(37(9)74)64(98)81-50(35(7)36(8)60(75)94)63(97)83-52-58(32(3)4)110-69(103)46-28-42(73)25-26-86(46)68(102)53(59(107-16)41-20-22-43(23-21-41)109-70-57(93)56(92)55(91)40(12)108-70)84-66(100)54(39(11)87)85(14)67(101)38(10)78-48(89)29-76-61(95)45(31-106-15)80-65(52)99/h18-24,27,32-33,35-40,42,45-47,50-59,70,87-88,91-93,105H,17,25-26,28-31,74H2,1-16H3,(H2,75,94)(H,76,95)(H,77,104)(H,78,89)(H,79,90)(H,80,99)(H,81,98)(H,82,96)(H,83,97)(H,84,100)/b24-19-,34-27+,44-18-/t33?,35-,36+,37-,38-,39+,40-,42-,45+,46-,47?,50-,51-,52+,53+,54-,55-,56+,57+,58+,59+,70-,72?/m0/s1
InChIKeyAPTOZTHRCLKEEQ-OJHSLUOMSA-N
Species of MetaboliteComponentSourceComments
Stephania cephalantha (ncbitaxon:152367)
stem (BTO:0001300) PubMed (21214233) 95% aqueous EtOH extract of dried and powdered leaves ans stems
leaf (BTO:0000713) PubMed (21214233) 95% aqueous EtOH extract of dried and powdered leaves ans stems
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 E (CHEBI:68403) has role metabolite (CHEBI:25212)
Mirabamide E (CHEBI:68403) is a organic molecular entity (CHEBI:50860)
Citations