Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C36H38N4O8.2ClH |
| Molecular Weight | 727.631 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.Cl.CC1=C(CCC(O)=O)C2=CC3=NC(=CC4=C(C)C(CCC(O)=O)=C(N4)C=C5N=C(C=C1N2)C(CCC(O)=O)=C5C)C(CCC(O)=O)=C3C
InChI
InChIKey=XROPZSRTTZKNQB-ARSPAUKVSA-N
InChI=1S/C36H38N4O8.2ClH/c1-17-21(5-9-33(41)42)29-14-26-19(3)23(7-11-35(45)46)31(39-26)16-28-20(4)24(8-12-36(47)48)32(40-28)15-27-18(2)22(6-10-34(43)44)30(38-27)13-25(17)37-29;;/h13-16,37,40H,5-12H2,1-4H3,(H,41,42)(H,43,44)(H,45,46)(H,47,48);2*1H/b25-13-,26-14-,27-15-,28-16-,29-14-,30-13-,31-16-,32-15-;;
| Molecular Formula | C36H38N4O8 |
| Molecular Weight | 654.7089 |
| 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
Wed Apr 02 16:29:57 GMT 2025
by
admin
on
Wed Apr 02 16:29:57 GMT 2025
|
| Record UNII |
CRY4BN6EBY
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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69477-27-6
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DTXSID00583469
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admin on Wed Apr 02 16:29:57 GMT 2025 , Edited by admin on Wed Apr 02 16:29:57 GMT 2025
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16211732
Created by
admin on Wed Apr 02 16:29:57 GMT 2025 , Edited by admin on Wed Apr 02 16:29:57 GMT 2025
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CRY4BN6EBY
Created by
admin on Wed Apr 02 16:29:57 GMT 2025 , Edited by admin on Wed Apr 02 16:29:57 GMT 2025
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| Related Record | Type | Details | ||
|---|---|---|---|---|
|
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