CHEBI:200170 - Miuraenamide D

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Miuraenamide D
ChEBI ID CHEBI:200170
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C34H42BrN3O7
Net Charge 0
Average Mass 684.628
Monoisotopic Mass 683.22061
InChI InChI=1S/C34H42BrN3O7/c1-21-11-9-10-14-29(40)36-23(3)33(42)38(4)27(20-24-17-18-28(39)26(35)19-24)32(41)37-30(34(43)45-22(2)16-15-21)31(44-5)25-12-7-6-8-13-25/h6-8,11-13,17-19,22-23,27,39H,9-10,14-16,20H2,1-5H3,(H,36,40)(H,37,41)/b21-11-,31-30-/t22-,23-,27+/m0/s1
InChIKey LOOHMHDNJMUEAT-AZUFOHQYSA-N
SMILES BrC1=C(O)C=CC(=C1)C[C@H]2N(C(=O)[C@@H](NC(=O)CCCC=C(CC[C@@H](OC(\C(\NC2=O)=C(\OC)/C3=CC=CC=C3)=O)C)C)C)C
Metabolite of Species Details
Paraliomyxa (NCBI:txid2983700) See: PubMed
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Miuraenamide D (CHEBI:200170) is a cyclodepsipeptide (CHEBI:35213)
IUPAC Name
(3Z,6R,9S,15Z,19S)-6-[(3-bromo-4-hydroxyphenyl)methyl]-3-[methoxy(phenyl)methylidene]-7,9,16,19-tetramethyl-1-oxa-4,7,10-triazacyclononadec-15-ene-2,5,8,11-tetrone
Manual Xref Database
78436590 ChemSpider
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