Okaramine H

AlkaPlorer ID: AK023314

Synonym: 'Okaramine H'

IUPAC Name: (1Z,4R,12S,14S,17Z)-12-hydroxy-19,19-dimethyl-7-(3-methylbut-2-enyl)-3,5,16,21-tetrazaheptacyclo[14.13.0.03,14.04,12.06,11.020,28.022,27]nonacosa-1(29),6,8,10,17,20(28),22,24,26-nonaene-2,15-dione

Structure

SMILES: CC(C)=CCC1=CC=CC2=C1N[C@@H]1N3C(=O)/C4=C/C5=C(NC6=CC=CC=C56)C(C)(C)/C=C\N4C(=O)[C@@H]3C[C@]21O

copy

InChI: InChI=1S/C32H32N4O3/c1-18(2)12-13-19-8-7-10-22-26(19)34-30-32(22,39)17-25-28(37)35-15-14-31(3,4)27-21(16-24(35)29(38)36(25)30)20-9-5-6-11-23(20)33-27/h5-12,14-16,25,30,33-34,39H,13,17H2,1-4H3/b15-14-,24-16-/t25-,30+,32-/m0/s1

copy

InChIKey: CNTMYVFPLVDMFY-HIVUMZBNSA-N

copy

Source

Properties Information

Molecule Weight: 520.6330000000003

TPSA: 88.67

MolLogP: 4.904900000000004

Number of H-Donors: 3

Number of H-Acceptors: 4

RingCount: 7

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information