Navigation

name Structure Reference Source Properties Activities Metabolism

(1R,4R,5S,6R,16S)-5,6-dihydroxy-6-[(1S)-1-hydroxyethyl]-4-isopropyl-2,8-dioxa-13-azatricyclo[8.5.1.0¹³,¹⁶]hexadec-10-ene-3,7-dione

AlkaPlorer ID: AK096330

Synonym: None

IUPAC Name: (1R,4R,5S,6R,16S)-5,6-dihydroxy-6-[(1S)-1-hydroxyethyl]-4-propan-2-yl-2,8-dioxa-13-azatricyclo[8.5.1.013,16]hexadec-10-ene-3,7-dione

Structure

SMILES: CC(C)[C@H]1C(=O)O[C@@H]2CCN3CC=C(COC(=O)[C@@](O)([C@H](C)O)[C@H]1O)[C@@H]23

copy

InChI: InChI=1S/C18H27NO7/c1-9(2)13-15(21)18(24,10(3)20)17(23)25-8-11-4-6-19-7-5-12(14(11)19)26-16(13)22/h4,9-10,12-15,20-21,24H,5-8H2,1-3H3/t10-,12+,13+,14-,15-,18+/m0/s1

copy

InChIKey: JGQRXNDIMGIXDT-DWJLGYJRSA-N

copy

Source

Species Genus Family Order Class Phylum Kingdom Domain
Crotalaria scassellatii Crotalaria Fabaceae Fabales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 369.414

TPSA？: 116.53

MolLogP？: -0.7856999999999983

Number of H-Donors: 3

Number of H-Acceptors: 8

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information