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

Details

Stereochemistry ABSOLUTE
Molecular Formula C19H20N2O
Molecular Weight 292.3749
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of VELLOSIMINE

SMILES

[H][C@]12CC3=C(NC4=CC=CC=C34)[C@]5([H])C[C@]([H])([C@H]1C=O)\C(C[N@]25)=C/C

InChI

InChIKey=MHASSCPGKAMILD-VICVVEARSA-N
InChI=1S/C19H20N2O/c1-2-11-9-21-17-8-14-12-5-3-4-6-16(12)20-19(14)18(21)7-13(11)15(17)10-22/h2-6,10,13,15,17-18,20H,7-9H2,1H3/b11-2-/t13-,15+,17-,18-/m0/s1

HIDE SMILES / InChI

Approval Year