Navigation

name Structure Reference Source Properties Activities Metabolism

(1R,9R,10S,12R,13R,16S)-16-[(1R)-1-hydroxyethyl]-8-methyl-15-oxa-8,18-diazahexacyclo[11.7.0.0¹,⁹.0²,⁷.0¹⁰,¹⁸.0¹²,¹⁶]icosa-2(7),3,5-trien-14-one

AlkaPlorer ID: AK215233

Synonym: None

IUPAC Name: (1R,9R,10S,12R,13R,16S)-16-[(1R)-1-hydroxyethyl]-8-methyl-15-oxa-8,18-diazahexacyclo[11.7.0.01,9.02,7.010,18.012,16]icosa-2,4,6-trien-14-one

Structure

SMILES: C[C@@H](O)[C@@]12CN3CC[C@@]45C6=CC=CC=C6N(C)[C@H]4[C@@H]3C[C@@H]1[C@H]5C(=O)O2

copy

InChI: InChI=1S/C20H24N2O3/c1-11(23)20-10-22-8-7-19-12-5-3-4-6-14(12)21(2)17(19)15(22)9-13(20)16(19)18(24)25-20/h3-6,11,13,15-17,23H,7-10H2,1-2H3/t11-,13-,15+,16+,17+,19+,20+/m1/s1

copy

InChIKey: XYFSMCRVYIHPSS-VWMRFIMHSA-N

copy

Source

Species Genus Family Order Class Phylum Kingdom Domain
Rauvolfia salicifolia Rauvolfia Apocynaceae Gentianales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 340.4230000000002

TPSA？: 53.010000000000005

MolLogP？: 1.1431999999999995

Number of H-Donors: 1

Number of H-Acceptors: 5

RingCount: 6

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information