(2S,3R,4E,6R)-4-hydroxyimino-3-methoxy-2-methyl-17-(propan-2-yloxymethyl)-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-nonaen-16-one (CHEBI:208757)

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CHEBI:208757 - (2S,3R,4E,6R)-4-hydroxyimino-3-methoxy-2-methyl-17-(propan-2-yloxymethyl)-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-nonaen-16-one

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ChEBI ID	CHEBI:208757
ChEBI Name	(2S,3R,4E,6R)-4-hydroxyimino-3-methoxy-2-methyl-17-(propan-2-yloxymethyl)-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-nonaen-16-one
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C31H30N4O5
Net Charge	0
Average Mass	538.604
Monoisotopic Mass	538.22162
SMILES	CO[C@@H]1/C(=N/O)C[C@H]2O[C@]1(C)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)C(=O)N(COC(C)C)C4
InChI	InChI=1S/C31H30N4O5/c1-16(2)39-15-33-14-19-24-18-10-6-8-12-22(18)35-28(24)27-25(26(19)30(33)36)17-9-5-7-11-21(17)34(27)23-13-20(32-37)29(38-4)31(35,3)40-23/h5-12,16,23,29,37H,13-15H2,1-4H3/b32-20+/t23-,29-,31+/m1/s1
InChIKey	AAVOQSXFLDIRRH-JUYSZZNHSA-N

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

ChEBI Ontology

Outgoing Relation(s)
	(2S,3R,4E,6R)-4-hydroxyimino-3-methoxy-2-methyl-17-(propan-2-yloxymethyl)-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-nonaen-16-one (CHEBI:208757) is a indolocarbazole (CHEBI:51915)

IUPAC Name
(2S,3R,4E,6R)-4-hydroxyimino-3-methoxy-2-methyl-17-(propan-2-yloxymethyl)-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-nonaen-16-one

Manual Xrefs	Databases
78440346	ChemSpider