Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C21H28O5.H2O |
| Molecular Weight | 378.4593 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 7 / 7 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O.[H][C@@]12CC[C@](O)(C(=O)C=O)[C@@]1(C)C[C@H](O)[C@@]3([H])[C@@]2([H])CCC4=CC(=O)CC[C@]34C
InChI
InChIKey=RHUDCNJUXZQHJL-WDCKKOMHSA-N
InChI=1S/C21H28O5.H2O/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19;/h9,11,14-16,18,24,26H,3-8,10H2,1-2H3;1H2/t14-,15-,16-,18+,19-,20-,21-;/m0./s1
| 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 |
| Molecular Formula | C21H28O5 |
| Molecular Weight | 360.444 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 7 / 7 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 14:11:04 GMT 2023
by
admin
on
Sat Dec 16 14:11:04 GMT 2023
|
| Record UNII |
FOL1F81T4A
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
| Name | Type | Language | ||
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Common Name | English | ||
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Systematic Name | English | ||
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Common Name | English |
| Code System | Code | Type | Description | ||
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FOL1F81T4A
Created by
admin on Sat Dec 16 14:11:04 GMT 2023 , Edited by admin on Sat Dec 16 14:11:04 GMT 2023
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PRIMARY | |||
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71748780
Created by
admin on Sat Dec 16 14:11:04 GMT 2023 , Edited by admin on Sat Dec 16 14:11:04 GMT 2023
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PRIMARY | |||
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906337-64-2
Created by
admin on Sat Dec 16 14:11:04 GMT 2023 , Edited by admin on Sat Dec 16 14:11:04 GMT 2023
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
PARENT -> SALT/SOLVATE | |||
|
ANHYDROUS->SOLVATE |
