(2S,3R,6R)-3-methoxy-2-methyl-29-oxa-1,7,17-triazaoctacyclo[12.12.2.12,6.07,28.08,13.015,19.020,27.021,26]nonacosa-8,10,12,14,19,21,23,25,27-nonaene-4,16-dione (CHEBI:199599)

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CHEBI:199599 - (2S,3R,6R)-3-methoxy-2-methyl-29-oxa-1,7,17-triazaoctacyclo[12.12.2.12,6.07,28.08,13.015,19.020,27.021,26]nonacosa-8,10,12,14,19,21,23,25,27-nonaene-4,16-dione

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ChEBI ID	CHEBI:199599
ChEBI Name	(2S,3R,6R)-3-methoxy-2-methyl-29-oxa-1,7,17-triazaoctacyclo[12.12.2.12,6.07,28.08,13.015,19.020,27.021,26]nonacosa-8,10,12,14,19,21,23,25,27-nonaene-4,16-dione
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C27H21N3O4
Net Charge	0
Average Mass	451.482
Monoisotopic Mass	451.15321
SMILES	CO[C@H]1C(=O)C[C@H]2O[C@]1(C)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)C(=O)NC4
InChI	InChI=1S/C27H21N3O4/c1-27-25(33-2)18(31)11-19(34-27)29-16-9-5-3-7-13(16)21-22-15(12-28-26(22)32)20-14-8-4-6-10-17(14)30(27)24(20)23(21)29/h3-10,19,25H,11-12H2,1-2H3,(H,28,32)/t19-,25+,27+/m1/s1
InChIKey	CQEYKSOPHNOEBZ-KAZGAHJFSA-N

Species of Metabolite	Component	Source	Comments
Streptomyces longisporoflavus (ncbitaxon:28044)	-	PubMed (8698633)

ChEBI Ontology

Outgoing Relation(s)
	(2S,3R,6R)-3-methoxy-2-methyl-29-oxa-1,7,17-triazaoctacyclo[12.12.2.12,6.07,28.08,13.015,19.020,27.021,26]nonacosa-8,10,12,14,19,21,23,25,27-nonaene-4,16-dione (CHEBI:199599) is a indolocarbazole (CHEBI:51915)

IUPAC Name
(2S,3R,6R)-3-methoxy-2-methyl-29-oxa-1,7,17-triazaoctacyclo[12.12.2.12,6.07,28.08,13.015,19.020,27.021,26]nonacosa-8,10,12,14,19,21,23,25,27-nonaene-4,16-dione

Manual Xrefs	Databases
8822591	ChemSpider