EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:42430 - methylpiperazinoforskolin

ChEBI IDCHEBI:42430
ChEBI Namemethylpiperazinoforskolin
Stars
Last Modified22 October 2007
DownloadsMolfile
FormulaC30H50N2O7
Net Charge0
Average Mass550.737
Monoisotopic Mass550.36180
SMILES[H]O[C@]1([H])[C@]([H])(OC(=O)C([H])([H])C([H])([H])C([H])([H])C([H])([H])N2C([H])([H])C([H])([H])N(C([H])([H])[H])C([H])([H])C2([H])[H])[C@@]2(C([H])([H])[H])O[C@](C([H])=C([H])[H])(C([H])([H])[H])C([H])([H])C(=O)[C@]2(O[H])[C@]2(C([H])([H])[H])[C@]1([H])C(C([H])([H])[H])(C([H])([H])[H])C([H])([H])C([H])([H])[C@]2([H])O[H]
InChIInChI=1S/C30H50N2O7/c1-8-27(4)19-21(34)30(37)28(5)20(33)12-13-26(2,3)24(28)23(36)25(29(30,6)39-27)38-22(35)11-9-10-14-32-17-15-31(7)16-18-32/h8,20,23-25,33,36-37H,1,9-19H2,2-7H3/t20-,23-,24-,25-,27-,28-,29+,30-/m0/s1
InChIKeyUNNWBVSRDSMIDQ-QAMJDCALSA-N
ChEBI Ontology
Outgoing Relation(s)
methylpiperazinoforskolin (CHEBI:42430) has functional parent forskolin (CHEBI:42471)
methylpiperazinoforskolin (CHEBI:42430) is a N-methylpiperazine (CHEBI:46920)
Synonyms  Source
METHYLPIPERAZINOFORSKOLINPDBeChem
(3R,4aR,5S,6S,6aS,10S,10aR,10bS)-3-ethenyl-6,10,10b-trihydroxy-3,4a,7,7,10a-pentamethyl-1-oxododecahydro-1H-benzo[f]chromen-5-yl 5-(4-methylpiperazin-1-yl)pentanoatePDBeChem
Manual XrefsDatabases
FKPPDBeChem