Carpatamide D (CHEBI:207097)

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CHEBI:207097 - Carpatamide D

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ChEBI ID	CHEBI:207097
ChEBI Name	Carpatamide D
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C20H27NO6
Net Charge	0
Average Mass	377.437
Monoisotopic Mass	377.18384
SMILES	CC(C)C/C=C/C=C/C(=O)N(CCO)c1cc(CCC(=O)O)c(O)cc1O
InChI	InChI=1S/C20H27NO6/c1-14(2)6-4-3-5-7-19(25)21(10-11-22)16-12-15(8-9-20(26)27)17(23)13-18(16)24/h3-5,7,12-14,22-24H,6,8-11H2,1-2H3,(H,26,27)/b4-3+,7-5+
InChIKey	YZXFOWJHEPOBBN-BDWKERMESA-N

Species of Metabolite	Component	Source	Comments
Streptomyces (ncbitaxon:1883)	-	PubMed (28225277)

Roles Classification

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

ChEBI Ontology

Outgoing Relation(s)
	Carpatamide D (CHEBI:207097) is a benzenes (CHEBI:22712)
	Carpatamide D (CHEBI:207097) is a monocarboxylic acid (CHEBI:25384)

IUPAC Name
3-[2,4-dihydroxy-5-[2-hydroxyethyl-[(2E,4E)-7-methylocta-2,4-dienoyl]amino]phenyl]propanoic acid

Manual Xrefs	Databases
61708557	ChemSpider