Epi-fiscalin A (CHEBI:203702)

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CHEBI:203702 - Epi-fiscalin A

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ChEBI ID	CHEBI:203702
ChEBI Name	Epi-fiscalin A
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C26H27N5O4
Net Charge	0
Average Mass	473.533
Monoisotopic Mass	473.20630
SMILES	CC(C)[C@H]1NC(=O)[C@@H](C[C@]2(O)c3ccccc3N3C(=O)[C@H](C)N[C@H]32)n2c1nc1ccccc1c2=O
InChI	InChI=1S/C26H27N5O4/c1-13(2)20-21-28-17-10-6-4-8-15(17)24(34)30(21)19(22(32)29-20)12-26(35)16-9-5-7-11-18(16)31-23(33)14(3)27-25(26)31/h4-11,13-14,19-20,25,27,35H,12H2,1-3H3,(H,29,32)/t14-,19+,20+,25+,26-/m0/s1
InChIKey	KGYYECCJAXZXMH-YNTSQJICSA-N

Species of Metabolite	Component	Source	Comments
Neosartorya (ncbitaxon:36629)	-	DOI (10.1016/j.tet.2012.02.024)

ChEBI Ontology

Outgoing Relation(s)
	Epi-fiscalin A (CHEBI:203702) is a quinazolines (CHEBI:38530)

IUPAC Name
(1R,4R)-4-[[(2S,3aR,4S)-4-hydroxy-2-methyl-1-oxo-3,3a-dihydro-2H-imidazo[1,2-a]indol-4-yl]methyl]-1-propan-2-yl-2,4-dihydro-1H-pyrazino[2,1-b]quinazoline-3,6-dione

Manual Xrefs	Databases
35003379	ChemSpider