UNPD123537

AlkaPlorer ID: AK318695

Synonym: None

IUPAC Name: None

Structure

SMILES: C/C=C1/C[N@+]2([O-])CC[C@@]34C5=CC=C(OC)C=C5N(C)[C@H]3[C@@H]2C[C@H]1[C@H]4C(=O)OC

copy

InChI: InChI=1S/C22H28N2O4/c1-5-13-12-24(26)9-8-22-16-7-6-14(27-3)10-17(16)23(2)20(22)18(24)11-15(13)19(22)21(25)28-4/h5-7,10,15,18-20H,8-9,11-12H2,1-4H3/b13-5-/t15-,18+,19+,20+,22+,24-/m1/s1

copy

InChIKey: BFJPLEYDDJAMHY-KWNPLERUSA-N

copy

Properties Information

Molecule Weight: 384.47600000000017

TPSA: 61.83

MolLogP: 2.6073000000000004

Number of H-Donors: 0

Number of H-Acceptors: 5

RingCount: 5

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information