Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C19H21ClN2OS.C4H6O6 |
Molecular Weight | 510.988 |
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.CCN(CC)CCOC1=CC=C(C=C1)C2=NC3=C(S2)C=CC(Cl)=C3
InChI
InChIKey=NKAVKFHIYALHRM-LREBCSMRSA-N
InChI=1S/C19H21ClN2OS.C4H6O6/c1-3-22(4-2)11-12-23-16-8-5-14(6-9-16)19-21-17-13-15(20)7-10-18(17)24-19;5-1(3(7)8)2(6)4(9)10/h5-10,13H,3-4,11-12H2,1-2H3;1-2,5-6H,(H,7,8)(H,9,10)/t;1-,2-/m.1/s1
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 |
Molecular Formula | C19H21ClN2OS |
Molecular Weight | 360.901 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 06:40:03 GMT 2023
by
admin
on
Sat Dec 16 06:40:03 GMT 2023
|
Record UNII |
K9P885JEKK
|
Record Status |
Validated (UNII)
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Record Version |
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-
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10390-80-4
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DTXSID90908662
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admin on Sat Dec 16 06:40:03 GMT 2023 , Edited by admin on Sat Dec 16 06:40:03 GMT 2023
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25224
Created by
admin on Sat Dec 16 06:40:03 GMT 2023 , Edited by admin on Sat Dec 16 06:40:03 GMT 2023
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K9P885JEKK
Created by
admin on Sat Dec 16 06:40:03 GMT 2023 , Edited by admin on Sat Dec 16 06:40:03 GMT 2023
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PRIMARY |
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ACTIVE MOIETY |