CHEBI:188551 - curine

ChEBI IDCHEBI:188551
ChEBI Namecurine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC36H38N2O6
Net Charge0
Average Mass594.708
Monoisotopic Mass594.27299
SMILES[H][C@@]12Cc3ccc(cc3)Oc3c(O)c(OC)cc4c3[C@@]([H])(Cc3ccc(O)c(c3)Oc3cc1c(cc3OC)CCN2C)N(C)CC4
InChIInChI=1S/C36H38N2O6/c1-37-13-11-23-18-31(41-3)32-20-26(23)27(37)15-21-5-8-25(9-6-21)43-36-34-24(19-33(42-4)35(36)40)12-14-38(2)28(34)16-22-7-10-29(39)30(17-22)44-32/h5-10,17-20,27-28,39-40H,11-16H2,1-4H3/t27-,28-/m1/s1
InChIKeyNGZXDRGWBULKFA-VSGBNLITSA-N
Species of MetaboliteComponentSourceComments
Phyllostachys violascens (ncbitaxon:1903417) stem (BTO:0001300) MetaboLights (MTBLS3970) Strain: Phyllostachys violascens cv. Viridisulcata
ChEBI Ontology
Outgoing Relation(s)
curine (CHEBI:188551) is a aromatic ether (CHEBI:35618)
IUPAC Name 
(1R,16R)-10,25-dimethoxy-15,30-dimethyl-7,23-dioxa-15,30-diazaheptacyclo[22.6.2.23,6.18,12.118,22.027,31.016,34]hexatriaconta-3(36),4,6(35),8(34),9,11,18(33),19,21,24,26,31-dodecaene-9,21-diol
Manual XrefsDatabases
222442ChemSpider
Registry NumbersSources
CAS:436-05-5ChemIDplus