[(3R)-2-oxo-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1H-indol-3-yl]acetic acid

AlkaPlorer ID: AK367872

Synonym: None

IUPAC Name: 2-[2-oxo-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1H-indol-3-yl]acetic acid

Structure

SMILES: O=C(O)CC1(OC2OC(CO)C(O)C(O)C2O)C(O)=NC2=CC=CC=C21

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InChI: InChI=1S/C16H19NO9/c18-6-9-11(21)12(22)13(23)14(25-9)26-16(5-10(19)20)7-3-1-2-4-8(7)17-15(16)24/h1-4,9,11-14,18,21-23H,5-6H2,(H,17,24)(H,19,20)

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InChIKey: DNQQEEOKVVSMQI-UHFFFAOYSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Prunus cerasus Prunus Rosaceae Rosales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 369.32600000000014

TPSA: 169.26999999999998

MolLogP: -1.225299999999999

Number of H-Donors: 6

Number of H-Acceptors: 8

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information