Details
Stereochemistry | ACHIRAL |
Molecular Formula | 2C20H31O2.Ca |
Molecular Weight | 646.996 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 8 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[Ca++].CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC([O-])=O.CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC([O-])=O
InChI
InChIKey=HUKAWWKDOTVOOF-IXKDQTEKSA-L
InChI=1S/2C20H32O2.Ca/c2*1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22;/h2*6-7,9-10,12-13,15-16H,2-5,8,11,14,17-19H2,1H3,(H,21,22);/q;;+2/p-2/b2*7-6-,10-9-,13-12-,16-15-;
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 | C20H31O2 |
Molecular Weight | 303.4589 |
Charge | -1 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 4 |
Optical Activity | NONE |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 09:27:09 UTC 2023
by
admin
on
Sat Dec 16 09:27:09 UTC 2023
|
Record UNII |
2C3051I0BG
|
Record Status |
Validated (UNII)
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Record Version |
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-
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2C3051I0BG
Created by
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87748487
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100000130925
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SUB44432
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133058-00-1
Created by
admin on Sat Dec 16 09:27:09 UTC 2023 , Edited by admin on Sat Dec 16 09:27:09 UTC 2023
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Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE |