Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C21H22N2O2.2H2O.AsH3O4 |
| Molecular Weight | 512.3852 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 6 / 6 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O.O.O[As](O)(O)=O.[H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6C7=C(C=CC=C7)[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H]
InChI
InChIKey=GOQVYJLWOHJJFJ-IOEZHPRESA-N
InChI=1S/C21H22N2O2.AsH3O4.2H2O/c24-18-10-16-19-13-9-17-21(6-7-22(17)11-12(13)5-8-25-16)14-3-1-2-4-15(14)23(18)20(19)21;2-1(3,4)5;;/h1-5,13,16-17,19-20H,6-11H2;(H3,2,3,4,5);2*1H2/t13-,16-,17-,19-,20-,21+;;;/m0.../s1
| Molecular Formula | C21H22N2O2 |
| Molecular Weight | 334.4116 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 5 / 6 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| Molecular Formula | AsH3O4 |
| Molecular Weight | 141.943 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| 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
Fri Dec 15 16:46:53 UTC 2023
by
admin
on
Fri Dec 15 16:46:53 UTC 2023
|
| Record UNII |
1NSF5D6RAK
|
| Record Status |
Validated (UNII)
|
| Record Version |
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-
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DTXSID70976485
Created by
admin on Fri Dec 15 16:46:53 UTC 2023 , Edited by admin on Fri Dec 15 16:46:53 UTC 2023
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PRIMARY | |||
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6101-00-4
Created by
admin on Fri Dec 15 16:46:53 UTC 2023 , Edited by admin on Fri Dec 15 16:46:53 UTC 2023
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71586865
Created by
admin on Fri Dec 15 16:46:53 UTC 2023 , Edited by admin on Fri Dec 15 16:46:53 UTC 2023
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1NSF5D6RAK
Created by
admin on Fri Dec 15 16:46:53 UTC 2023 , Edited by admin on Fri Dec 15 16:46:53 UTC 2023
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> SALT/SOLVATE | |||
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PARENT -> SALT/SOLVATE | |||
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ANHYDROUS->SOLVATE |
