Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C15H19NO3S2.C6H14N4O2 |
Molecular Weight | 499.647 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 4 / 4 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
N[C@@H](CCCNC(N)=N)C(O)=O.C[C@H](CS)C(=O)N1C[C@H](C[C@H]1C(O)=O)SC2=CC=CC=C2
InChI
InChIKey=OSKWTWSFSUAPKP-KQUFBQNASA-N
InChI=1S/C15H19NO3S2.C6H14N4O2/c1-10(9-20)14(17)16-8-12(7-13(16)15(18)19)21-11-5-3-2-4-6-11;7-4(5(11)12)2-1-3-10-6(8)9/h2-6,10,12-13,20H,7-9H2,1H3,(H,18,19);4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t10-,12+,13+;4-/m10/s1
Molecular Formula | C6H14N4O2 |
Molecular Weight | 174.201 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Molecular Formula | C15H19NO3S2 |
Molecular Weight | 325.446 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 3 / 3 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 15:49:37 GMT 2023
by
admin
on
Fri Dec 15 15:49:37 GMT 2023
|
Record UNII |
36F26ZSQ0D
|
Record Status |
Validated (UNII)
|
Record Version |
|
-
Download
Name | Type | Language | ||
---|---|---|---|---|
|
Official Name | English | ||
|
Code | English | ||
|
Common Name | English | ||
|
Code | English |
Classification Tree | Code System | Code | ||
---|---|---|---|---|
|
NCI_THESAURUS |
C247
Created by
admin on Fri Dec 15 15:49:37 GMT 2023 , Edited by admin on Fri Dec 15 15:49:37 GMT 2023
|
Code System | Code | Type | Description | ||
---|---|---|---|---|---|
|
11954366
Created by
admin on Fri Dec 15 15:49:37 GMT 2023 , Edited by admin on Fri Dec 15 15:49:37 GMT 2023
|
PRIMARY | |||
|
DTXSID701002278
Created by
admin on Fri Dec 15 15:49:37 GMT 2023 , Edited by admin on Fri Dec 15 15:49:37 GMT 2023
|
PRIMARY | |||
|
81872-09-5
Created by
admin on Fri Dec 15 15:49:37 GMT 2023 , Edited by admin on Fri Dec 15 15:49:37 GMT 2023
|
PRIMARY | |||
|
BB-47
Created by
admin on Fri Dec 15 15:49:37 GMT 2023 , Edited by admin on Fri Dec 15 15:49:37 GMT 2023
|
PRIMARY | |||
|
36F26ZSQ0D
Created by
admin on Fri Dec 15 15:49:37 GMT 2023 , Edited by admin on Fri Dec 15 15:49:37 GMT 2023
|
PRIMARY | |||
|
C66700
Created by
admin on Fri Dec 15 15:49:37 GMT 2023 , Edited by admin on Fri Dec 15 15:49:37 GMT 2023
|
PRIMARY |
Related Record | Type | Details | ||
---|---|---|---|---|
|
PARENT -> SALT/SOLVATE | |||
|
PARENT -> SALT/SOLVATE |