Bromosalinosporamide (CHEBI:198639)

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CHEBI:198639 - Bromosalinosporamide

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ChEBI ID	CHEBI:198639
ChEBI Name	Bromosalinosporamide
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C15H20BrNO4
Net Charge	0
Average Mass	358.232
Monoisotopic Mass	357.05757
SMILES	C[C@@]12OC(=O)[C@]1([C@@H](O)[C@@H]1C=CCCC1)NC(=O)[C@@H]2CCBr
InChI	InChI=1S/C15H20BrNO4/c1-14-10(7-8-16)12(19)17-15(14,13(20)21-14)11(18)9-5-3-2-4-6-9/h3,5,9-11,18H,2,4,6-8H2,1H3,(H,17,19)/t9-,10+,11+,14+,15+/m1/s1
InChIKey	UPZYHLMZJCVNAY-SHTIJGAHSA-N

Species of Metabolite	Component	Source	Comments
Salinispora tropica (ncbitaxon:168695)	-	PubMed (17243724)

ChEBI Ontology

Outgoing Relation(s)
	Bromosalinosporamide (CHEBI:198639) has functional parent α-amino acid (CHEBI:33704)
	Bromosalinosporamide (CHEBI:198639) is a organonitrogen compound (CHEBI:35352)
	Bromosalinosporamide (CHEBI:198639) is a organooxygen compound (CHEBI:36963)

IUPAC Name
(1R,4R,5S)-4-(2-bromoethyl)-1-[(S)-[(1S)-cyclohex-2-en-1-yl]-hydroxymethyl]-5-methyl-6-oxa-2-azabicyclo[3.2.0]heptane-3,7-dione

Manual Xrefs	Databases
9849582	ChemSpider