Halolitoralin C (CHEBI:221356)

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CHEBI:221356 - Halolitoralin C

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ChEBI ID	CHEBI:221356
ChEBI Name	Halolitoralin C
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C23H42N4O4
Net Charge	0
Average Mass	438.613
Monoisotopic Mass	438.32061
SMILES	CC[C@H](C)[C@@H]1NC(=O)[C@H](CC(C)C)NC(=O)[C@H]([C@@H](C)CC)NC(=O)[C@H](C(C)C)NC1=O
InChI	InChI=1S/C23H42N4O4/c1-9-14(7)18-22(30)24-16(11-12(3)4)20(28)26-19(15(8)10-2)23(31)25-17(13(5)6)21(29)27-18/h12-19H,9-11H2,1-8H3,(H,24,30)(H,25,31)(H,26,28)(H,27,29)/t14-,15-,16-,17-,18-,19-/m0/s1
InChIKey	ACTUUECIBHHYLY-DYKIIFRCSA-N

Species of Metabolite	Component	Source	Comments
Halobacillus (ncbitaxon:45667)	-	DOI (10.1016/s0040-4039(02)01458-2)

Roles Classification

Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid).

ChEBI Ontology

Outgoing Relation(s)
	Halolitoralin C (CHEBI:221356) is a oligopeptide (CHEBI:25676)

IUPAC Name
(3S,6S,9S,12S)-3,9-bis[(2S)-butan-2-yl]-6-(2-methylpropyl)-12-propan-2-yl-1,4,7,10-tetrazacyclododecane-2,5,8,11-tetrone

Manual Xrefs	Databases
9986868	ChemSpider