Madindoline A/B (CHEBI:203906)

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CHEBI:203906 - Madindoline A/B

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ChEBI ID	CHEBI:203906
ChEBI Name	Madindoline A/B
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C22H29NO4
Net Charge	0
Average Mass	371.477
Monoisotopic Mass	371.20966
SMILES	CCCCC1C(=O)C(C)(CN2c3ccccc3C3(O)CCOC23)C(=O)C1C
InChI	InChI=1S/C22H29NO4/c1-4-5-8-15-14(2)18(24)21(3,19(15)25)13-23-17-10-7-6-9-16(17)22(26)11-12-27-20(22)23/h6-7,9-10,14-15,20,26H,4-5,8,11-13H2,1-3H3
InChIKey	YJLIDBBCWAQBOC-UHFFFAOYSA-N

Species of Metabolite	Component	Source	Comments
Streptomyces (ncbitaxon:1883)	-	PubMed (8982336)

ChEBI Ontology

Outgoing Relation(s)
	Madindoline A/B (CHEBI:203906) is a indoles (CHEBI:24828)

IUPAC Name
2-[(8b-hydroxy-2,3a-dihydro-1H-uro[2,3-b]indol-4-yl)methyl]-4-butyl-2,5-dimethylcyclopentane-1,3-dione

Manual Xrefs	Databases
8039920	ChemSpider