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Details

Stereochemistry ABSOLUTE
Molecular Formula C27H25NO5
Molecular Weight 443.4911
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 14-CINNAMOYLOXYCODEINONE

SMILES

[H][C@@]12OC3=C(OC)C=CC4=C3[C@@]15CCN(C)[C@H](C4)[C@]5(OC(=O)\C=C\C6=CC=CC=C6)C=CC2=O

InChI

InChIKey=BWZTYCFJIMYOHI-JKGZCERPSA-N
InChI=1S/C27H25NO5/c1-28-15-14-26-23-18-9-10-20(31-2)24(23)32-25(26)19(29)12-13-27(26,21(28)16-18)33-22(30)11-8-17-6-4-3-5-7-17/h3-13,21,25H,14-16H2,1-2H3/b11-8+/t21-,25+,26+,27-/m1/s1

HIDE SMILES / InChI

Molecular Formula C27H25NO5
Molecular Weight 443.4911
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
M9VES83RLJ
Record Status Validated (UNII)
Record Version