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CHEBI:65582 - Carmabin A

ChEBI IDCHEBI:65582
ChEBI NameCarmabin A
Stars
DefinitionA natural product found in Lyngbya majuscula and Lyngbya majuscula.
Last Modified22 September 2014
DownloadsMolfile
FormulaC40H57N5O6
Net Charge0
Average Mass703.925
Monoisotopic Mass703.43088
SMILESC#CCCCCC(C)CC(C)C(=O)N(C)[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N(C)[C@@H](C)C(=O)N(C)[C@@H](Cc1ccc(OC)cc1)C(N)=O
InChIInChI=1S/C40H57N5O6/c1-10-11-12-14-17-27(2)24-28(3)38(48)45(8)35(26-31-18-15-13-16-19-31)37(47)42-29(4)39(49)43(6)30(5)40(50)44(7)34(36(41)46)25-32-20-22-33(51-9)23-21-32/h1,13,15-16,18-23,27-30,34-35H,11-12,14,17,24-26H2,2-9H3,(H2,41,46)(H,42,47)/t27?,28?,29-,30-,34-,35-/m0/s1
InChIKeyBRWIYXLUWTZWGU-PBQPNXEGSA-N
Species of MetaboliteComponentSourceComments
Lyngbya majuscula (ncbitaxon:158786)
- PubMed (17441769) Panamanian strain of the marine cyanobacterium
- PubMed (9584405) Caribbean variety of Marine cyanobacterium
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)
Carmabin A (CHEBI:65582) has role metabolite (CHEBI:25212)
Carmabin A (CHEBI:65582) is a peptide (CHEBI:16670)
Synonym  Source
N-[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-amino-3-(4-methoxyphenyl)-1-oxopropan-2-yl]-methylamino]-1-oxopropan-2-yl]-methylamino]-1-oxopropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]-N,2,4-trimethyldec-9-ynamideChEBI
Citations