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Details

Stereochemistry ABSOLUTE
Molecular Formula C23H29N3O2
Molecular Weight 379.4953
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CYMSERINE

SMILES

[H][C@]12N(C)CC[C@@]1(C)C3=CC(OC(=O)NC4=CC=C(C=C4)C(C)C)=CC=C3N2C

InChI

InChIKey=NKJRRVBTMYRXRB-GGAORHGYSA-N
InChI=1S/C23H29N3O2/c1-15(2)16-6-8-17(9-7-16)24-22(27)28-18-10-11-20-19(14-18)23(3)12-13-25(4)21(23)26(20)5/h6-11,14-15,21H,12-13H2,1-5H3,(H,24,27)/t21-,23+/m1/s1

HIDE SMILES / InChI

Molecular Formula C23H29N3O2
Molecular Weight 379.4953
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
EOI96371PZ
Record Status Validated (UNII)
Record Version