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Details

Stereochemistry ACHIRAL
Molecular Formula C22H18N2O2S2
Molecular Weight 406.521
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0
Stereo Comments Cis-trans

SHOW SMILES / InChI
Structure of PTERYGOSPERMIN, CIS-

SMILES

S=C1O[C@]2(C=C[C@@]3(OC(=S)N3CC4=CC=CC=C4)C=C2)N1CC5=CC=CC=C5

InChI

InChIKey=OGWNPNIRZURLGD-SZPZYZBQSA-N
InChI=1S/C22H18N2O2S2/c27-19-23(15-17-7-3-1-4-8-17)21(25-19)11-13-22(14-12-21)24(20(28)26-22)16-18-9-5-2-6-10-18/h1-14H,15-16H2/t21-,22+

HIDE SMILES / InChI

Molecular Formula C22H18N2O2S2
Molecular Weight 406.521
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 15:06:30 GMT 2023
Edited
by admin
on Sat Dec 16 15:06:30 GMT 2023
Record UNII
O0BHN4MR9T
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PTERYGOSPERMIN, CIS-
Common Name English
Code System Code Type Description
FDA UNII
O0BHN4MR9T
Created by admin on Sat Dec 16 15:06:30 GMT 2023 , Edited by admin on Sat Dec 16 15:06:30 GMT 2023
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