Details
Stereochemistry | ABSOLUTE |
Molecular Formula | 2C19H21N2O3.Ca |
Molecular Weight | 690.841 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[Ca++].CCCC[C@@H](C([O-])=O)C(=O)N(NC1=CC=CC=C1)C2=CC=CC=C2.CCCC[C@@H](C([O-])=O)C(=O)N(NC3=CC=CC=C3)C4=CC=CC=C4
InChI
InChIKey=RKINNRASCJRSHD-NCTGSHGJSA-L
InChI=1S/2C19H22N2O3.Ca/c2*1-2-3-14-17(19(23)24)18(22)21(16-12-8-5-9-13-16)20-15-10-6-4-7-11-15;/h2*4-13,17,20H,2-3,14H2,1H3,(H,23,24);/q;;+2/p-2/t2*17-;/m11./s1
Molecular Formula | Ca |
Molecular Weight | 40.078 |
Charge | 2 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C19H21N2O3 |
Molecular Weight | 325.3816 |
Charge | -1 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 01:28:59 GMT 2023
by
admin
on
Sat Dec 16 01:28:59 GMT 2023
|
Record UNII |
V069JL816T
|
Record Status |
Validated (UNII)
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Record Version |
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-
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Systematic Name | English |
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76964352
Created by
admin on Sat Dec 16 01:28:59 GMT 2023 , Edited by admin on Sat Dec 16 01:28:59 GMT 2023
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PRIMARY | |||
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V069JL816T
Created by
admin on Sat Dec 16 01:28:59 GMT 2023 , Edited by admin on Sat Dec 16 01:28:59 GMT 2023
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PRIMARY |
Related Record | Type | Details | ||
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RACEMATE -> ENANTIOMER |