Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C25H38N2O6S.C9H8O2 |
| Molecular Weight | 642.803 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 1 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)\C=C\C1=CC=CC=C1.NS(=O)(=O)C2=CC=CC(CCCCOCCCCCCNC[C@H](O)C3=CC(CO)=C(O)C=C3)=C2
InChI
InChIKey=YAZYYGDPISTBAK-DTHFRSEHSA-N
InChI=1S/C25H38N2O6S.C9H8O2/c26-34(31,32)23-10-7-9-20(16-23)8-3-6-15-33-14-5-2-1-4-13-27-18-25(30)21-11-12-24(29)22(17-21)19-28;10-9(11)7-6-8-4-2-1-3-5-8/h7,9-12,16-17,25,27-30H,1-6,8,13-15,18-19H2,(H2,26,31,32);1-7H,(H,10,11)/b;7-6+/t25-;/m0./s1
| Molecular Formula | C25H38N2O6S |
| Molecular Weight | 494.644 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| Molecular Formula | C9H8O2 |
| Molecular Weight | 148.1586 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 1 |
| Optical Activity | NONE |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 10:14:55 GMT 2023
by
admin
on
Sat Dec 16 10:14:55 GMT 2023
|
| Record UNII |
B623P04DB3
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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| Code System | Code | Type | Description | ||
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42611263
Created by
admin on Sat Dec 16 10:14:55 GMT 2023 , Edited by admin on Sat Dec 16 10:14:55 GMT 2023
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PRIMARY | |||
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870265-58-0
Created by
admin on Sat Dec 16 10:14:55 GMT 2023 , Edited by admin on Sat Dec 16 10:14:55 GMT 2023
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NO STRUCTURE GIVEN | |||
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B623P04DB3
Created by
admin on Sat Dec 16 10:14:55 GMT 2023 , Edited by admin on Sat Dec 16 10:14:55 GMT 2023
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PRIMARY | |||
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1144522-84-8
Created by
admin on Sat Dec 16 10:14:55 GMT 2023 , Edited by admin on Sat Dec 16 10:14:55 GMT 2023
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PRIMARY |
| Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE |
| Related Record | Type | Details | ||
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ACTIVE MOIETY |