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CHEBI:210215 - Majusculamide C

ChEBI IDCHEBI:210215
ChEBI NameMajusculamide C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC50H80N8O12
Net Charge0
Average Mass985.234
Monoisotopic Mass984.58957
SMILESCCC(C)C1OC(=O)C(C)C(CC)NC(=O)C(C)NC(=O)C(C)(C)C(=O)C(C)NC(=O)C(Cc2ccc(OC)cc2)N(C)C(=O)C(C(C)C)N(C)C(=O)CNC(=O)C(C(C)CC)N(C)C(=O)CNC1=O
InChIInChI=1S/C50H80N8O12/c1-17-28(6)40-45(64)51-25-37(59)57(14)39(27(4)5)47(66)56(13)36(24-33-20-22-34(69-16)23-21-33)44(63)53-31(9)42(61)50(11,12)49(68)54-32(10)43(62)55-35(19-3)30(8)48(67)70-41(29(7)18-2)46(65)52-26-38(60)58(40)15/h20-23,27-32,35-36,39-41H,17-19,24-26H2,1-16H3,(H,51,64)(H,52,65)(H,53,63)(H,54,68)(H,55,62)
InChIKeyKDZUJZSBNBCYEK-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Lyngbya majuscula (ncbitaxon:158786) - DOI (10.1021/jo00176a004)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Majusculamide C (CHEBI:210215) is a cyclodepsipeptide (CHEBI:35213)
IUPAC Name 
2,8-di(butan-2-yl)-28-ethyl-17-[(4-methoxyphenyl)methyl]-7,13,16,20,22,22,25,29-octamethyl-14-propan-2-yl-1-oxa-4,7,10,13,16,19,24,27-octazacyclotriacontane-3,6,9,12,15,18,21,23,26,30-decone
Manual XrefsDatabases
10469608ChemSpider