U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C36H38N2O6
Molecular Weight 594.6967
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of AROMOLINE

SMILES

COC1=CC2=C3C=C1OC4=C(O)C(OC)=CC5=C4[C@H](CC6=CC=C(OC7=C(O)C=CC(C[C@H]3N(C)CC2)=C7)C=C6)N(C)CC5

InChI

InChIKey=LFFQVHXIFJLJSP-IZLXSDGUSA-N
InChI=1S/C36H38N2O6/c1-37-13-11-23-18-31(41-3)32-20-26(23)27(37)16-22-7-10-29(39)30(17-22)43-25-8-5-21(6-9-25)15-28-34-24(12-14-38(28)2)19-33(42-4)35(40)36(34)44-32/h5-10,17-20,27-28,39-40H,11-16H2,1-4H3/t27-,28+/m1/s1

HIDE SMILES / InChI

Approval Year