WS-7338 D (CHEBI:197967)

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CHEBI:197967 - WS-7338 D

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ChEBI ID	CHEBI:197967
ChEBI Name	WS-7338 D
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C29H40N6O7
Net Charge	0
Average Mass	584.674
Monoisotopic Mass	584.29585
SMILES	CC(C)[C@@H]1NC(=O)[C@H](C)NC(=O)[C@@H](CCC(=O)O)NC(=O)[C@H](Cc2cnc3ccccc23)NC(=O)[C@@H](C(C)C)NC1=O
InChI	InChI=1S/C29H40N6O7/c1-14(2)23-28(41)33-21(12-17-13-30-19-9-7-6-8-18(17)19)27(40)32-20(10-11-22(36)37)26(39)31-16(5)25(38)34-24(15(3)4)29(42)35-23/h6-9,13-16,20-21,23-24,30H,10-12H2,1-5H3,(H,31,39)(H,32,40)(H,33,41)(H,34,38)(H,35,42)(H,36,37)/t16-,20+,21-,23+,24-/m0/s1
InChIKey	DSYDICXVMGUOGE-UWLAMGOFSA-N

Species of Metabolite	Component	Source	Comments
Streptomyces (ncbitaxon:1883)	-	PubMed (1312521)

Roles Classification

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

ChEBI Ontology

Outgoing Relation(s)
	WS-7338 D (CHEBI:197967) is a cyclic peptide (CHEBI:23449)

IUPAC Name
3-[(2R,5S,8S,11R,14S)-14-(1H-indol-3-ylmethyl)-5-methyl-3,6,9,12,15-pentaoxo-8,11-di(propan-2-yl)-1,4,7,10,13-pentazacyclopentadec-2-yl]propanoic acid

Manual Xrefs	Databases
78440704	ChemSpider