5-[hydroxy({7-methyl-5H,6H,7H-cyclopenta[c]pyridin-4-yl})methyl]-7-methyl-5H,6H,7H-cyclopenta[c]pyridine-4-carbaldehyde

AlkaPlorer ID: AK253808

Synonym: None

IUPAC Name: (5R,7R)-5-[(S)-hydroxy-[(7R)-7-methyl-6,7-dihydro-5H-cyclopenta[c]pyridin-4-yl]methyl]-7-methyl-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbaldehyde

Structure

SMILES: C[C@@H]1CCC2=C1C=NC=C2[C@@H](O)[C@@H]1C[C@@H](C)C2=CN=CC(C=O)=C21

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InChI: InChI=1S/C20H22N2O2/c1-11-3-4-14-16(11)7-22-9-18(14)20(24)15-5-12(2)17-8-21-6-13(10-23)19(15)17/h6-12,15,20,24H,3-5H2,1-2H3/t11-,12-,15-,20+/m1/s1

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InChIKey: KNMAEYCFFQTEKI-UVHYSYGYSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Incarvillea arguta Incarvillea Bignoniaceae Lamiales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 322.4080000000001

TPSA: 63.080000000000005

MolLogP: 3.6632000000000025

Number of H-Donors: 1

Number of H-Acceptors: 4

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information