Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C18H20N2O3S |
| Molecular Weight | 344.428 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CNCCN1C2=CC=CC=C2S[C@H]([C@@H](O)C1=O)C3=CC=C(O)C=C3
InChI
InChIKey=ZTRZZXJIQHVVGS-SJORKVTESA-N
InChI=1S/C18H20N2O3S/c1-19-10-11-20-14-4-2-3-5-15(14)24-17(16(22)18(20)23)12-6-8-13(21)9-7-12/h2-9,16-17,19,21-22H,10-11H2,1H3/t16-,17+/m1/s1
| Molecular Formula | C18H20N2O3S |
| Molecular Weight | 344.428 |
| 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
Edited
Sat Dec 16 09:39:59 GMT 2023
by
admin
on
Sat Dec 16 09:39:59 GMT 2023
|
| Record UNII |
2JQ1D3G54H
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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2JQ1D3G54H
Created by
admin on Sat Dec 16 09:39:59 GMT 2023 , Edited by admin on Sat Dec 16 09:39:59 GMT 2023
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86408-42-6
Created by
admin on Sat Dec 16 09:39:59 GMT 2023 , Edited by admin on Sat Dec 16 09:39:59 GMT 2023
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10472681
Created by
admin on Sat Dec 16 09:39:59 GMT 2023 , Edited by admin on Sat Dec 16 09:39:59 GMT 2023
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> METABOLITE |
MINOR
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