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CHEBI:68406 - Mirabamide H

ChEBI IDCHEBI:68406
ChEBI NameMirabamide H
Stars
DefinitionA natural product found in Stelletta clavosa.
Last Modified22 September 2014
DownloadsMolfile
FormulaC66H102ClN13O19
Net Charge0
Average Mass1417.067
Monoisotopic Mass1415.71035
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)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/C66H102ClN13O19/c1-16-32(5)26-33(6)18-23-46(83)36(9)57(87)70-29-48(85)73-43(17-2)59(89)76-50(37(10)68)61(91)75-49(34(7)35(8)56(69)86)60(90)77-51-54(31(3)4)99-66(96)45-27-41(67)24-25-80(45)65(95)52(55(98-15)40-19-21-42(82)22-20-40)78-63(93)53(39(12)81)79(13)64(94)38(11)72-47(84)28-71-58(88)44(30-97-14)74-62(51)92/h17-23,26,31-32,34-39,41,44-46,49-55,81-83H,16,24-25,27-30,68H2,1-15H3,(H2,69,86)(H,70,87)(H,71,88)(H,72,84)(H,73,85)(H,74,92)(H,75,91)(H,76,89)(H,77,90)(H,78,93)/b23-18-,33-26+,43-17-/t32?,34-,35+,36?,37-,38-,39+,41-,44+,45-,46?,49-,50-,51+,52+,53-,54+,55+/m0/s1
InChIKeyJTGKDTRWYWFPLP-HEIJXINOSA-N
Species of MetaboliteComponentSourceComments
Stelletta clavosa (WORMS:169915) - PubMed (21280591) Methanolic extract of frozen sponge
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
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 H (CHEBI:68406) has role metabolite (CHEBI:25212)
Mirabamide H (CHEBI:68406) is a polypeptide (CHEBI:15841)
Citations