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Details

Stereochemistry ABSOLUTE
Molecular Formula C6H11NOS2
Molecular Weight 177.288
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of SULFORAPHANE, (S)-

SMILES

C[S@+]([O-])CCCCN=C=S

InChI

InChIKey=SUVMJBTUFCVSAD-JTQLQIEISA-N
InChI=1S/C6H11NOS2/c1-10(8)5-3-2-4-7-6-9/h2-5H2,1H3/t10-/m0/s1

HIDE SMILES / InChI

Molecular Formula C6H11NOS2
Molecular Weight 177.288
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 17:18:37 GMT 2023
Edited
by admin
on Fri Dec 15 17:18:37 GMT 2023
Record UNII
7J94TPZ10L
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SULFORAPHANE, (S)-
Common Name English
(S)-SULFORAPHANE
Common Name English
BUTANE, 1-ISOTHIOCYANATO-4-(METHYLSULFINYL)-, (S)-
Common Name English
BUTANE, 1-ISOTHIOCYANATO-4-((S)-METHYLSULFINYL)-
Systematic Name English
Code System Code Type Description
CAS
155320-20-0
Created by admin on Fri Dec 15 17:18:37 GMT 2023 , Edited by admin on Fri Dec 15 17:18:37 GMT 2023
PRIMARY
PUBCHEM
10419733
Created by admin on Fri Dec 15 17:18:37 GMT 2023 , Edited by admin on Fri Dec 15 17:18:37 GMT 2023
PRIMARY
FDA UNII
7J94TPZ10L
Created by admin on Fri Dec 15 17:18:37 GMT 2023 , Edited by admin on Fri Dec 15 17:18:37 GMT 2023
PRIMARY