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Details

Stereochemistry ABSOLUTE
Molecular Formula C21H20N2O3
Molecular Weight 348.3951
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SERPENTINE

SMILES

[H][C@]12C[N+]3=C(C[C@]1([H])C(=CO[C@H]2C)C(=O)OC)C4=C(C=C3)C5=C([N-]4)C=CC=C5

InChI

InChIKey=WYTGDNHDOZPMIW-VBNZEHGJSA-N
InChI=1S/C21H20N2O3/c1-12-16-10-23-8-7-14-13-5-3-4-6-18(13)22-20(14)19(23)9-15(16)17(11-26-12)21(24)25-2/h3-8,11-12,15-16H,9-10H2,1-2H3/t12-,15-,16+/m0/s1

HIDE SMILES / InChI

Molecular Formula C21H20N2O3
Molecular Weight 348.3951
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

PubMed

Substance Class Chemical
Record UNII
B503RKE34F
Record Status Validated (UNII)
Record Version