Magallanesine

AlkaPlorer ID: AK237737

Synonym: None

IUPAC Name: 8,9-dimethoxy-18,20-dioxa-12-azapentacyclo[13.7.0.04,12.05,10.017,21]docosa-1(22),3,5(10),6,8,15,17(21)-heptaene-2,11-dione

Structure

SMILES: COC1=CC=C2C3=CC(=O)C4=CC5=C(C=C4CCN3C(=O)C2=C1OC)OCO5

copy

InChI: InChI=1S/C21H17NO6/c1-25-16-4-3-12-14-9-15(23)13-8-18-17(27-10-28-18)7-11(13)5-6-22(14)21(24)19(12)20(16)26-2/h3-4,7-9H,5-6,10H2,1-2H3

copy

InChIKey: LMJDZJPJOKSKSR-UHFFFAOYSA-N

copy

Reference

PubChem CID: 85375244

COCONUT: CNP0293714

Source

Properties Information

Molecule Weight: 379.36800000000017

TPSA: 74.30000000000001

MolLogP: 2.668200000000001

Number of H-Donors: 0

Number of H-Acceptors: 6

RingCount: 5

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information