Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C17H23Cl2NO.C6H8O7 |
Molecular Weight | 520.4 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 4 / 4 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)CC(O)(CC(O)=O)C(O)=O.CCOC[C@H]1[C@H]2CC[C@@H](C[C@@H]1C3=CC(Cl)=C(Cl)C=C3)N2C
InChI
InChIKey=ZIVJUFNVDKADJT-BEDQTAKTSA-N
InChI=1S/C17H23Cl2NO.C6H8O7/c1-3-21-10-14-13(9-12-5-7-17(14)20(12)2)11-4-6-15(18)16(19)8-11;7-3(8)1-6(13,5(11)12)2-4(9)10/h4,6,8,12-14,17H,3,5,7,9-10H2,1-2H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/t12-,13+,14+,17+;/m0./s1
Molecular Formula | C17H23Cl2NO |
Molecular Weight | 328.277 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 4 / 4 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Molecular Formula | C6H8O7 |
Molecular Weight | 192.1235 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 01:00:06 UTC 2023
by
admin
on
Sat Dec 16 01:00:06 UTC 2023
|
Record UNII |
3R9T98ZB7U
|
Record Status |
Validated (UNII)
|
Record Version |
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-
Download
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Common Name | English | ||
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Systematic Name | English |
Code System | Code | Type | Description | ||
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861205-83-6
Created by
admin on Sat Dec 16 01:00:06 UTC 2023 , Edited by admin on Sat Dec 16 01:00:06 UTC 2023
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PRIMARY | |||
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195875-86-6
Created by
admin on Sat Dec 16 01:00:06 UTC 2023 , Edited by admin on Sat Dec 16 01:00:06 UTC 2023
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NON-SPECIFIC STOICHIOMETRY | |||
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11421038
Created by
admin on Sat Dec 16 01:00:06 UTC 2023 , Edited by admin on Sat Dec 16 01:00:06 UTC 2023
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PRIMARY | |||
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3R9T98ZB7U
Created by
admin on Sat Dec 16 01:00:06 UTC 2023 , Edited by admin on Sat Dec 16 01:00:06 UTC 2023
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PRIMARY | |||
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m10592
Created by
admin on Sat Dec 16 01:00:06 UTC 2023 , Edited by admin on Sat Dec 16 01:00:06 UTC 2023
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PRIMARY | Merck Index | ||
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DBSALT001991
Created by
admin on Sat Dec 16 01:00:06 UTC 2023 , Edited by admin on Sat Dec 16 01:00:06 UTC 2023
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PRIMARY |
Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE |
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Related Record | Type | Details | ||
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ACTIVE MOIETY |