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

Details

Stereochemistry ABSOLUTE
Molecular Formula C20H28O3
Molecular Weight 316.4345
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of CINERIN I

SMILES

C\C=C/CC1=C(C)[C@H](CC1=O)OC(=O)[C@@H]2[C@@H](C=C(C)C)C2(C)C

InChI

InChIKey=FMTFEIJHMMQUJI-DFKXKMKHSA-N
InChI=1S/C20H28O3/c1-7-8-9-14-13(4)17(11-16(14)21)23-19(22)18-15(10-12(2)3)20(18,5)6/h7-8,10,15,17-18H,9,11H2,1-6H3/b8-7-/t15-,17+,18+/m1/s1

HIDE SMILES / InChI

Approval Year