Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C16H20N2.2C16H18N2O5S |
Molecular Weight | 941.122 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 6 / 6 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
C(CNCC1=CC=CC=C1)NCC2=CC=CC=C2.[H][C@]34SC(C)(C)[C@@]([H])(N3C(=O)[C@@]4([H])NC(=O)COC5=CC=CC=C5)C(O)=O.[H][C@]67SC(C)(C)[C@@]([H])(N6C(=O)[C@@]7([H])NC(=O)COC8=CC=CC=C8)C(O)=O
InChI
InChIKey=BBTOYUUSUQNIIY-ANPZCEIESA-N
InChI=1S/2C16H18N2O5S.C16H20N2/c2*1-16(2)12(15(21)22)18-13(20)11(14(18)24-16)17-10(19)8-23-9-6-4-3-5-7-9;1-3-7-15(8-4-1)13-17-11-12-18-14-16-9-5-2-6-10-16/h2*3-7,11-12,14H,8H2,1-2H3,(H,17,19)(H,21,22);1-10,17-18H,11-14H2/t2*11-,12+,14-;/m11./s1
Molecular Formula | C16H20N2 |
Molecular Weight | 240.3434 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C16H18N2O5S |
Molecular Weight | 350.39 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 3 / 3 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 18:37:57 UTC 2023
by
admin
on
Fri Dec 15 18:37:57 UTC 2023
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Record UNII |
3T4EMH59ZU
|
Record Status |
Validated (UNII)
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Record Version |
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-
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Classification Tree | Code System | Code | ||
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WHO-ATC |
J01CE10
Created by
admin on Fri Dec 15 18:37:57 UTC 2023 , Edited by admin on Fri Dec 15 18:37:57 UTC 2023
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WHO-VATC |
QJ01CE10
Created by
admin on Fri Dec 15 18:37:57 UTC 2023 , Edited by admin on Fri Dec 15 18:37:57 UTC 2023
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Code System | Code | Type | Description | ||
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4440
Created by
admin on Fri Dec 15 18:37:57 UTC 2023 , Edited by admin on Fri Dec 15 18:37:57 UTC 2023
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PRIMARY | |||
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227-667-2
Created by
admin on Fri Dec 15 18:37:57 UTC 2023 , Edited by admin on Fri Dec 15 18:37:57 UTC 2023
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31973
Created by
admin on Fri Dec 15 18:37:57 UTC 2023 , Edited by admin on Fri Dec 15 18:37:57 UTC 2023
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PRIMARY | |||
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CHEMBL615
Created by
admin on Fri Dec 15 18:37:57 UTC 2023 , Edited by admin on Fri Dec 15 18:37:57 UTC 2023
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C015707
Created by
admin on Fri Dec 15 18:37:57 UTC 2023 , Edited by admin on Fri Dec 15 18:37:57 UTC 2023
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3T4EMH59ZU
Created by
admin on Fri Dec 15 18:37:57 UTC 2023 , Edited by admin on Fri Dec 15 18:37:57 UTC 2023
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Benzathine phenoxymethylpenicillin
Created by
admin on Fri Dec 15 18:37:57 UTC 2023 , Edited by admin on Fri Dec 15 18:37:57 UTC 2023
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DBSALT001952
Created by
admin on Fri Dec 15 18:37:57 UTC 2023 , Edited by admin on Fri Dec 15 18:37:57 UTC 2023
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18926
Created by
admin on Fri Dec 15 18:37:57 UTC 2023 , Edited by admin on Fri Dec 15 18:37:57 UTC 2023
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PRIMARY | RxNorm | ||
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DTXSID80207999
Created by
admin on Fri Dec 15 18:37:57 UTC 2023 , Edited by admin on Fri Dec 15 18:37:57 UTC 2023
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C166695
Created by
admin on Fri Dec 15 18:37:57 UTC 2023 , Edited by admin on Fri Dec 15 18:37:57 UTC 2023
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64725
Created by
admin on Fri Dec 15 18:37:57 UTC 2023 , Edited by admin on Fri Dec 15 18:37:57 UTC 2023
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PRIMARY | |||
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SUB03763MIG
Created by
admin on Fri Dec 15 18:37:57 UTC 2023 , Edited by admin on Fri Dec 15 18:37:57 UTC 2023
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100000085294
Created by
admin on Fri Dec 15 18:37:57 UTC 2023 , Edited by admin on Fri Dec 15 18:37:57 UTC 2023
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5928-84-7
Created by
admin on Fri Dec 15 18:37:57 UTC 2023 , Edited by admin on Fri Dec 15 18:37:57 UTC 2023
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PRIMARY | |||
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m8479
Created by
admin on Fri Dec 15 18:37:57 UTC 2023 , Edited by admin on Fri Dec 15 18:37:57 UTC 2023
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PRIMARY | Merck Index |
Related Record | Type | Details | ||
---|---|---|---|---|
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SOLVATE->ANHYDROUS |
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PARENT -> SALT/SOLVATE |