Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C16H20N2.2C16H18N2O4S.4H2O |
Molecular Weight | 981.185 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 6 / 6 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
O.O.O.O.C(CNCC1=CC=CC=C1)NCC2=CC=CC=C2.[H][C@]34SC(C)(C)[C@@H](N3C(=O)[C@H]4NC(=O)CC5=CC=CC=C5)C(O)=O.[H][C@]67SC(C)(C)[C@@H](N6C(=O)[C@H]7NC(=O)CC8=CC=CC=C8)C(O)=O
InChI
InChIKey=WIDKTXGNSOORHA-CJHXQPGBSA-N
InChI=1S/2C16H18N2O4S.C16H20N2.4H2O/c2*1-16(2)12(15(21)22)18-13(20)11(14(18)23-16)17-10(19)8-9-6-4-3-5-7-9;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;4*1H2/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 | H2O |
Molecular Weight | 18.0153 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C16H18N2O4S |
Molecular Weight | 334.39 |
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 14:59:10 UTC 2023
by
admin
on
Fri Dec 15 14:59:10 UTC 2023
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Record UNII |
RIT82F58GK
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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-ESSENTIAL MEDICINES LIST |
6.2.1
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WHO-ATC |
J01CE08
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CFR |
21 CFR 522.1696A
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admin on Fri Dec 15 14:59:10 UTC 2023 , Edited by admin on Fri Dec 15 14:59:10 UTC 2023
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WHO-VATC |
QJ51RC24
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admin on Fri Dec 15 14:59:10 UTC 2023 , Edited by admin on Fri Dec 15 14:59:10 UTC 2023
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NCI_THESAURUS |
C1500
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admin on Fri Dec 15 14:59:10 UTC 2023 , Edited by admin on Fri Dec 15 14:59:10 UTC 2023
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WHO-VATC |
QJ01CE08
Created by
admin on Fri Dec 15 14:59:10 UTC 2023 , Edited by admin on Fri Dec 15 14:59:10 UTC 2023
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RIT82F58GK
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4347
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1502009
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SUB37626
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DTXSID00194317
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7982
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PRIMARY | RxNorm | ||
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100000129194
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656811
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m8475
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41372-02-5
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BENZATHINE BENZYLPENICILLIN
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C47657
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DBSALT002769
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51352
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SUB05741MIG
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PRIMARY |
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EP
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IMPURITY -> PARENT |
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IMPURITY -> PARENT |
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