None

AlkaPlorer ID: AK471074

Synonym: None

IUPAC Name: (1R,4E,6R,7R,17R)-7-hydroxy-4-(2-hydroxyethylidene)-6,7-dimethyl-2,9-dioxa-14-azatricyclo[9.5.1.014,17]heptadec-11-ene-3,8-dione

Structure

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

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InChI: InChI=1S/C18H25NO6/c1-11-9-12(5-8-20)16(21)25-14-4-7-19-6-3-13(15(14)19)10-24-17(22)18(11,2)23/h3,5,11,14-15,20,23H,4,6-10H2,1-2H3/b12-5+/t11-,14-,15-,18-/m1/s1

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InChIKey: NSKVSAYYBLAAGQ-SANHKKAYSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Jacobaea argunensis Jacobaea Asteraceae Asterales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 351.39900000000006

TPSA: 96.3

MolLogP: 0.1652

Number of H-Donors: 2

Number of H-Acceptors: 7

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information