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

Details

Stereochemistry ABSOLUTE
Molecular Formula C26H29NO5
Molecular Weight 435.5122
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of VERTINE

SMILES

[H][C@]12C[C@@]3([H])CCCCN3[C@@]([H])(C1)C4=CC(OC)=C(OC)C=C4C5=CC(=CC=C5O)C=CC(=O)O2

InChI

InChIKey=WCZWUYYJZVBKDZ-VMSBZHFZSA-N
InChI=1S/C26H29NO5/c1-30-24-14-19-20(15-25(24)31-2)22-13-18(12-17-5-3-4-10-27(17)22)32-26(29)9-7-16-6-8-23(28)21(19)11-16/h6-9,11,14-15,17-18,22,28H,3-5,10,12-13H2,1-2H3/b9-7-/t17-,18+,22+/m1/s1

HIDE SMILES / InChI

Approval Year