Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C17H19NO4.ClH.H2O |
Molecular Weight | 355.813 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 4 / 4 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
O.Cl.CN1CC[C@@]23[C@H]4OC5=C2C(C[C@@H]1[C@]3(O)CCC4=O)=CC=C5O
InChI
InChIKey=VLPORDTVKOPOLC-YNLRGPPVSA-N
InChI=1S/C17H19NO4.ClH.H2O/c1-18-7-6-16-13-9-2-3-10(19)14(13)22-15(16)11(20)4-5-17(16,21)12(18)8-9;;/h2-3,12,15,19,21H,4-8H2,1H3;1H;1H2/t12-,15+,16+,17-;;/m1../s1
Molecular Formula | C17H19NO4 |
Molecular Weight | 301.3371 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 4 / 4 |
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 |
Molecular Formula | ClH |
Molecular Weight | 36.461 |
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
Sat Dec 16 11:28:08 UTC 2023
by
admin
on
Sat Dec 16 11:28:08 UTC 2023
|
Record UNII |
CV52YZ5G1X
|
Record Status |
Validated (UNII)
|
Record Version |
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-
Download
Name | Type | Language | ||
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Common Name | English | ||
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Systematic Name | English |
Code System | Code | Type | Description | ||
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1415015-79-0
Created by
admin on Sat Dec 16 11:28:08 UTC 2023 , Edited by admin on Sat Dec 16 11:28:08 UTC 2023
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PRIMARY | |||
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1033330-03-8
Created by
admin on Sat Dec 16 11:28:08 UTC 2023 , Edited by admin on Sat Dec 16 11:28:08 UTC 2023
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NON-SPECIFIC STOICHIOMETRY | |||
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68792735
Created by
admin on Sat Dec 16 11:28:08 UTC 2023 , Edited by admin on Sat Dec 16 11:28:08 UTC 2023
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PRIMARY | |||
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CV52YZ5G1X
Created by
admin on Sat Dec 16 11:28:08 UTC 2023 , Edited by admin on Sat Dec 16 11:28:08 UTC 2023
|
PRIMARY |
Related Record | Type | Details | ||
---|---|---|---|---|
|
ANHYDROUS->SOLVATE | |||
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PARENT -> SALT/SOLVATE |