Anicemycin (CHEBI:211360)

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CHEBI:211360 - Anicemycin

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ChEBI ID	CHEBI:211360
ChEBI Name	Anicemycin
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C30H49N7O7
Net Charge	0
Average Mass	619.764
Monoisotopic Mass	619.36935
SMILES	CC(C)CCC/C=C\CCCCCCCC(=O)NCC(=O)N[C@@H]1[C@@H](O)[C@@H](O)C(Nc2ncnc3ncnc23)O[C@H]1[C@@H](O)CO
InChI	InChI=1S/C30H49N7O7/c1-19(2)13-11-9-7-5-3-4-6-8-10-12-14-21(40)31-15-22(41)36-23-25(42)26(43)30(44-27(23)20(39)16-38)37-29-24-28(33-17-32-24)34-18-35-29/h5,7,17-20,23,25-27,30,38-39,42-43H,3-4,6,8-16H2,1-2H3,(H,31,40)(H,36,41)(H2,32,33,34,35,37)/b7-5-/t20-,23+,25+,26+,27-,30?/m0/s1
InChIKey	MHXSLJSEZYHPNN-TYCKKTRZSA-N

Species of Metabolite	Component	Source	Comments
Streptomyces (ncbitaxon:1883)	-	PubMed (16060384)

Roles Classification

Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base).

ChEBI Ontology

Outgoing Relation(s)
	Anicemycin (CHEBI:211360) is a N-acyl-amino acid (CHEBI:51569)

IUPAC Name
(Z)-N-[2-[[(2R,3R,4R,5R)-2-[(1S)-1,2-dihydroxyethyl]-4,5-dihydroxy-6-(7H-purin-6-ylamino)oxan-3-yl]amino]-2-oxoethyl]-14-methylpentadec-9-enamide

Manual Xrefs	Databases
78438517	ChemSpider