3,4,5-trihydroxy-1-{9H-pyrido[3,4-b]indol-1-yl}pentan-1-one

AlkaPlorer ID: AK268065

Synonym: None

IUPAC Name: 3,4,5-trihydroxy-1-(9H-pyrido[3,4-b]indol-1-yl)pentan-1-one

Structure

SMILES: O=C(CC(O)C(O)CO)C1=NC=CC2=C1NC1=CC=CC=C12

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InChI: InChI=1S/C16H16N2O4/c19-8-14(22)12(20)7-13(21)16-15-10(5-6-17-16)9-3-1-2-4-11(9)18-15/h1-6,12,14,18-20,22H,7-8H2

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InChIKey: RSEGMZMZRFXVDC-UHFFFAOYSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Crocus sativus Crocus Iridaceae Asparagales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 300.314

TPSA: 106.44

MolLogP: 1.003

Number of H-Donors: 4

Number of H-Acceptors: 5

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information