Alphostatin (CHEBI:221852)

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CHEBI:221852 - Alphostatin

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ChEBI ID	CHEBI:221852
ChEBI Name	Alphostatin
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C25H45N6O13P
Net Charge	0
Average Mass	668.638
Monoisotopic Mass	668.27822
SMILES	CC[C@H](C)[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](COP(=O)(O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)CC
InChI	InChI=1S/C25H45N6O13P/c1-5-12(3)19(27)23(37)31-20(13(4)6-2)24(38)30-16(11-44-45(41,42)43)22(36)28-14(7-9-17(26)32)21(35)29-15(25(39)40)8-10-18(33)34/h12-16,19-20H,5-11,27H2,1-4H3,(H2,26,32)(H,28,36)(H,29,35)(H,30,38)(H,31,37)(H,33,34)(H,39,40)(H2,41,42,43)/t12-,13-,14-,15-,16-,19-,20-/m0/s1
InChIKey	MUMGYSCBSNMHKQ-NKURYSMOSA-N

Species of Metabolite	Component	Source	Comments
Bacillus (ncbitaxon:1386)	-	PubMed (2496067)

Roles Classification

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

ChEBI Ontology

Outgoing Relation(s)
	Alphostatin (CHEBI:221852) is a oligopeptide (CHEBI:25676)

IUPAC Name
(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S,3S)-2-[[(2S,3S)-2-amino-3-methylpentanoyl]amino]-3-methylpentanoyl]amino]-3-phosphonooxypropanoyl]amino]-5-oxopentanoyl]amino]pentanedioic acid

Manual Xrefs	Databases
62916448	ChemSpider