(1S,15R,17S,18S,19R)-5,7-dioxa-12-azapentacyclo[10.6.1.0²,¹⁰.0⁴,⁸.0¹⁵,¹⁹]nonadeca-2(10),3,8-triene-17,18-diol

AlkaPlorer ID: AK547891

Synonym: None

IUPAC Name: (1S,17R,18S)-5,7-dioxa-12-azapentacyclo[10.6.1.02,10.04,8.015,19]nonadeca-2,4(8),9-triene-17,18-diol

Structure

SMILES: O[C@@H]1[C@H](O)CC2CCN3CC4=CC5=C(C=C4[C@H]1C23)OCO5

copy

InChI: InChI=1S/C16H19NO4/c18-11-3-8-1-2-17-6-9-4-12-13(21-7-20-12)5-10(9)14(15(8)17)16(11)19/h4-5,8,11,14-16,18-19H,1-3,6-7H2/t8?,11-,14+,15?,16-/m1/s1

copy

InChIKey: VJILFEGOWCJNIK-QQCODEPSSA-N

copy

Source

Properties Information

Molecule Weight: 289.3310000000001

TPSA: 62.16000000000001

MolLogP: 0.8285

Number of H-Donors: 2

Number of H-Acceptors: 5

RingCount: 5

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information