Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | 2C15H13O3.Ca |
| Molecular Weight | 522.602 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[Ca++].C[C@@H](C([O-])=O)C1=CC=CC(OC2=CC=CC=C2)=C1.C[C@@H](C([O-])=O)C3=CC=CC(OC4=CC=CC=C4)=C3
InChI
InChIKey=VHUXSAWXWSTUOD-ZVRYYDNZSA-L
InChI=1S/2C15H14O3.Ca/c2*1-11(15(16)17)12-6-5-9-14(10-12)18-13-7-3-2-4-8-13;/h2*2-11H,1H3,(H,16,17);/q;;+2/p-2/t2*11-;/m11./s1
| Molecular Formula | C15H13O3 |
| Molecular Weight | 241.2619 |
| Charge | -1 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| 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 |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 21:10:27 GMT 2025
by
admin
on
Mon Mar 31 21:10:27 GMT 2025
|
| Record UNII |
C95YO0B9FB
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
| Name | Type | Language | ||
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Preferred Name | English | ||
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Common Name | English |
| Code System | Code | Type | Description | ||
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C95YO0B9FB
Created by
admin on Mon Mar 31 21:10:27 GMT 2025 , Edited by admin on Mon Mar 31 21:10:27 GMT 2025
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PRIMARY | |||
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76956414
Created by
admin on Mon Mar 31 21:10:27 GMT 2025 , Edited by admin on Mon Mar 31 21:10:27 GMT 2025
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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RACEMATE -> ENANTIOMER |
