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Details

Stereochemistry RACEMIC
Molecular Formula C26H30O4
Molecular Weight 406.514
Optical Activity ( + / - )
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PANDURATIN A

SMILES

COC1=CC(O)=C(C(=O)[C@@H]2[C@H](CC=C(C)C)C(C)=CC[C@H]2C3=CC=CC=C3)C(O)=C1

InChI

InChIKey=LYDZCXVWCFJAKQ-ZFGGDYGUSA-N
InChI=1S/C26H30O4/c1-16(2)10-12-20-17(3)11-13-21(18-8-6-5-7-9-18)24(20)26(29)25-22(27)14-19(30-4)15-23(25)28/h5-11,14-15,20-21,24,27-28H,12-13H2,1-4H3/t20-,21+,24-/m1/s1

HIDE SMILES / InChI

Approval Year

PubMed