Dichotomocej D (CHEBI:213030)

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CHEBI:213030 - Dichotomocej D

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ChEBI ID	CHEBI:213030
ChEBI Name	Dichotomocej D
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C23H30N2O3
Net Charge	0
Average Mass	382.504
Monoisotopic Mass	382.22564
SMILES	C/C=C/C=C(/C)C(=O)N[C@H](COC(=O)Cc1cnc2ccccc12)CC(C)C
InChI	InChI=1S/C23H30N2O3/c1-5-6-9-17(4)23(27)25-19(12-16(2)3)15-28-22(26)13-18-14-24-21-11-8-7-10-20(18)21/h5-11,14,16,19,24H,12-13,15H2,1-4H3,(H,25,27)/b6-5+,17-9-/t19-/m0/s1
InChIKey	XAFLMOKLZWDATP-XQMNPTEPSA-N

Species of Metabolite	Component	Source	Comments
Dichotomomyces (ncbitaxon:255780)	-	PubMed (29104243)

Roles Classification

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

ChEBI Ontology

Outgoing Relation(s)
	Dichotomocej D (CHEBI:213030) is a indole-3-acetic acids (CHEBI:24803)

IUPAC Name
[(2S)-4-methyl-2-[[(2Z,4E)-2-methylhexa-2,4-dienoyl]amino]pentyl] 2-(1H-indol-3-yl)acetate

Manual Xrefs	Databases
62816284	ChemSpider