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

Details

Stereochemistry MIXED
Molecular Formula C22H26O6
Molecular Weight 386.4382
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 6
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DI-P-METHYLBENZYLIDENESORBITOL

SMILES

[H][C@]12COC(O[C@@]1([H])[C@]([H])(OC(O2)C3=CC=C(C)C=C3)[C@H](O)CO)C4=CC=C(C)C=C4

InChI

InChIKey=LQAFKEDMOAMGAK-RLCYQCIGSA-N
InChI=1S/C22H26O6/c1-13-3-7-15(8-4-13)21-25-12-18-20(28-21)19(17(24)11-23)27-22(26-18)16-9-5-14(2)6-10-16/h3-10,17-24H,11-12H2,1-2H3/t17-,18+,19-,20-,21?,22?/m1/s1

HIDE SMILES / InChI

Approval Year