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CHEBI:199574 - N-methylsansalvamide

ChEBI IDCHEBI:199574
ChEBI NameN-methylsansalvamide
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC33H52N4O6
Net Charge0
Average Mass600.801
Monoisotopic Mass600.38869
SMILESCC(C)C[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](C(C)C)NC(=O)[C@H](CC(C)C)OC1=O
InChIInChI=1S/C33H52N4O6/c1-19(2)15-25-33(42)43-27(17-21(5)6)31(40)36-28(22(7)8)32(41)37(9)26(16-20(3)4)30(39)34-24(29(38)35-25)18-23-13-11-10-12-14-23/h10-14,19-22,24-28H,15-18H2,1-9H3,(H,34,39)(H,35,38)(H,36,40)/t24-,25-,26-,27-,28-/m0/s1
InChIKeyYMJKISFVUDJIHL-XLIKFSOKSA-N
Species of MetaboliteComponentSourceComments
Fusarium (ncbitaxon:5506) - DOI (10.1016/s0031-9422(00)00280-6)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
N-methylsansalvamide (CHEBI:199574) is a cyclodepsipeptide (CHEBI:35213)
IUPAC Name 
(3S,6S,9S,12S,15S)-6-benzyl-10-methyl-3,9,15-tris(2-methylpropyl)-12-propan-2-yl-1-oxa-4,7,10,13-tetrazacyclopentadecane-2,5,8,11,14-pentone
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553451ChemSpider