Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C13H16O10.2H2O |
| Molecular Weight | 368.2907 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 5 / 5 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O.O.OC[C@H]1O[C@H](OC(=O)C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O
InChI
InChIKey=VHBZCGMOXZMBHH-CLJCBRTASA-N
InChI=1S/C13H16O10.2H2O/c14-3-7-9(18)10(19)11(20)13(22-7)23-12(21)4-1-5(15)8(17)6(16)2-4;;/h1-2,7,9-11,13-20H,3H2;2*1H2/t7-,9-,10+,11-,13-;;/m1../s1
| Molecular Formula | C13H16O10 |
| Molecular Weight | 332.2601 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 5 / 5 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| Molecular Formula | H2O |
| Molecular Weight | 18.0153 |
| 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
Mon Mar 31 22:34:47 GMT 2025
by
admin
on
Mon Mar 31 22:34:47 GMT 2025
|
| Record UNII |
XOI483BPTB
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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Common Name | English | ||
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Preferred Name | English | ||
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Common Name | English |
| Code System | Code | Type | Description | ||
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m5759
Created by
admin on Mon Mar 31 22:34:47 GMT 2025 , Edited by admin on Mon Mar 31 22:34:47 GMT 2025
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PRIMARY | Merck Index | ||
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XOI483BPTB
Created by
admin on Mon Mar 31 22:34:47 GMT 2025 , Edited by admin on Mon Mar 31 22:34:47 GMT 2025
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PRIMARY | |||
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90478519
Created by
admin on Mon Mar 31 22:34:47 GMT 2025 , Edited by admin on Mon Mar 31 22:34:47 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
ANHYDROUS->SOLVATE |