Molecule

Malassezindole A

AlkaPlorer ID: AK096604

Synonym: None

IUPAC Name: (2S,5R)-5-(1H-indol-3-yl)-4-oxo-2,3,5,6-tetrahydro-1H-azepino[4,5-b]indole-2-carboxylic acid

Structure

SMILES: O=C(O)[C@@H]1CC2=C(NC3=CC=CC=C23)[C@@H](C2=CNC3=CC=CC=C23)C(O)=N1

InChI: InChI=1S/C21H17N3O3/c25-20-18(14-10-22-15-7-3-1-6-12(14)15)19-13(9-17(24-20)21(26)27)11-5-2-4-8-16(11)23-19/h1-8,10,17-18,22-23H,9H2,(H,24,25)(H,26,27)/t17-,18+/m0/s1

InChIKey: ZPYSWVAWFDJYIM-ZWKOTPCHSA-N

Reference

New Tryptophan Metabolites from Cultures of the Lipophilic Yeast <i>Malassezia furfur</i>

PubChem CID: 101746397

LOTUS: LTS0023146

NPASS: NPC85182

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Ainsliaea acerifolia	Ainsliaea	Asteraceae	Asterales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Polystichum aculeatum	Polystichum	Dryopteridaceae	Polypodiales	Polypodiopsida	Streptophyta	Viridiplantae	Eukaryota
Xanthium strumarium	Xanthium	Asteraceae	Asterales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Frangula alnus	Frangula	Rhamnaceae	Rosales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Corydalis scouleri	Corydalis	Papaveraceae	Ranunculales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Cotoneaster salicifolius	Cotoneaster	Rosaceae	Rosales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Protea eximia	Protea	Proteaceae	Proteales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Cystophora congesta	Cystophora	Sargassaceae	Fucales	Phaeophyceae	None	None	Eukaryota
Salvia clevelandii	Salvia	Lamiaceae	Lamiales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota

Properties Information

Molecule Weight: 359.3850000000001

TPSA？: 101.47

MolLogP？: 3.746900000000002

Number of H-Donors: 4

Number of H-Acceptors: 2

RingCount: 5

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi