Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C17H22N2S.C4H6O6 |
Molecular Weight | 436.522 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
O[C@H]([C@@H](O)C(O)=O)C(O)=O.CN1CCC(CC1)N(CC2=CC=CS2)C3=CC=CC=C3
InChI
InChIKey=JNZAGODMPIMPAM-LREBCSMRSA-N
InChI=1S/C17H22N2S.C4H6O6/c1-18-11-9-16(10-12-18)19(14-17-8-5-13-20-17)15-6-3-2-4-7-15;5-1(3(7)8)2(6)4(9)10/h2-8,13,16H,9-12,14H2,1H3;1-2,5-6H,(H,7,8)(H,9,10)/t;1-,2-/m.1/s1
Molecular Formula | C17H22N2S |
Molecular Weight | 286.435 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C4H6O6 |
Molecular Weight | 150.0868 |
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
Fri Dec 15 17:59:11 UTC 2023
by
admin
on
Fri Dec 15 17:59:11 UTC 2023
|
Record UNII |
H581Q95SJA
|
Record Status |
Validated (UNII)
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Record Version |
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-
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16509-35-6
Created by
admin on Fri Dec 15 17:59:11 UTC 2023 , Edited by admin on Fri Dec 15 17:59:11 UTC 2023
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DTXSID90937038
Created by
admin on Fri Dec 15 17:59:11 UTC 2023 , Edited by admin on Fri Dec 15 17:59:11 UTC 2023
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SUB04771MIG
Created by
admin on Fri Dec 15 17:59:11 UTC 2023 , Edited by admin on Fri Dec 15 17:59:11 UTC 2023
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27900
Created by
admin on Fri Dec 15 17:59:11 UTC 2023 , Edited by admin on Fri Dec 15 17:59:11 UTC 2023
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H581Q95SJA
Created by
admin on Fri Dec 15 17:59:11 UTC 2023 , Edited by admin on Fri Dec 15 17:59:11 UTC 2023
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220-493-8
Created by
admin on Fri Dec 15 17:59:11 UTC 2023 , Edited by admin on Fri Dec 15 17:59:11 UTC 2023
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100000084801
Created by
admin on Fri Dec 15 17:59:11 UTC 2023 , Edited by admin on Fri Dec 15 17:59:11 UTC 2023
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2784-55-6
Created by
admin on Fri Dec 15 17:59:11 UTC 2023 , Edited by admin on Fri Dec 15 17:59:11 UTC 2023
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PRIMARY |
Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE | |||
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PARENT -> SALT/SOLVATE |
Related Record | Type | Details | ||
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ACTIVE MOIETY |