3-chloro-4-ethenyl-4,9,9,20,20-pentamethyl-5-(methylideneamino)-7-oxa-11-azahexacyclo[14.3.1.0?,¹?.0?,?.0¹?,¹?.0¹²,¹?]icosa-10(18),12(17),13,15-tetraen-19-ol

AlkaPlorer ID: AK261459

Synonym: None

IUPAC Name: 3-chloro-4-ethenyl-4,9,9,20,20-pentamethyl-5-(methylideneamino)-7-oxa-11-azahexacyclo[14.3.1.05,19.06,8.010,18.012,17]icosa-10(18),12,14,16-tetraen-19-ol

Structure

SMILES: C=CC1(C)C(Cl)CC2C(C)(C)C3=CC=CC4=C3C3=C(N4)C(C)(C)C4OC4C1(N=C)C32O

copy

InChI: InChI=1S/C26H31ClN2O2/c1-8-24(6)16(27)12-15-22(2,3)13-10-9-11-14-17(13)18-19(29-14)23(4,5)20-21(31-20)26(24,28-7)25(15,18)30/h8-11,15-16,20-21,29-30H,1,7,12H2,2-6H3

copy

InChIKey: MKRVHEXNGFBKJC-UHFFFAOYSA-N

copy

Source

Properties Information

Molecule Weight: 438.99900000000025

TPSA: 60.91

MolLogP: 4.964300000000006

Number of H-Donors: 2

Number of H-Acceptors: 3

RingCount: 6

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information