CHEBI:202363 - Carneamide C

ChEBI IDCHEBI:202363
ChEBI NameCarneamide C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC27H31N3O3
Net Charge0
Average Mass445.563
Monoisotopic Mass445.23654
SMILESCC1(C)C=Cc2cc3c4c(nc3cc2O1)C(C)(C)C=CN1C(=O)[C@@H]2CCCN2C(=O)[C@]1(C)C4
InChIInChI=1S/C27H31N3O3/c1-25(2)10-12-30-23(31)20-7-6-11-29(20)24(32)27(30,5)15-18-17-13-16-8-9-26(3,4)33-21(16)14-19(17)28-22(18)25/h8-10,12-14,20,28H,6-7,11,15H2,1-5H3/t20-,27-/m0/s1
InChIKeyZWBYURXCFGRPSW-DCFHFQCYSA-N
Species of MetaboliteComponentSourceComments
Aspergillus (ncbitaxon:5052) - PubMed (22658281)
ChEBI Ontology
Outgoing Relation(s)
Carneamide C (CHEBI:202363) is a 1-benzopyran (CHEBI:38443)
IUPAC Name 
(3S,9S)-3,14,14,21,21-pentamethyl-20-oxa-5,11,16-triazahexacyclo[13.11.0.03,11.05,9.017,26.019,24]hexacosa-1(15),12,17(26),18,22,24-hexaene-4,10-dione