Details
| Stereochemistry | MIXED |
| Molecular Formula | C34H38N4O6.ClH.H2O |
| Molecular Weight | 653.165 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 0 / 2 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O.Cl.CC(O)C1=C(C)C2=CC3=C(C(C)O)C(C)=C(N3)C=C4N=C(C=C5NC(=CC1=N2)C(C)=C5CCC(O)=O)C(CCC(O)=O)=C4C
InChI
InChIKey=DJUQXKVMJTWUCD-UDHHKLSBSA-N
InChI=1S/C34H38N4O6.ClH.H2O/c1-15-21(7-9-31(41)42)27-14-28-22(8-10-32(43)44)16(2)24(36-28)12-29-34(20(6)40)18(4)26(38-29)13-30-33(19(5)39)17(3)25(37-30)11-23(15)35-27;;/h11-14,19-20,36-37,39-40H,7-10H2,1-6H3,(H,41,42)(H,43,44);1H;1H2/b23-11-,24-12-,25-11-,26-13-,27-14-,28-14-,29-12-,30-13-;;
| 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 | C34H36N4O6 |
| Molecular Weight | 596.6728 |
| Charge | 0 |
| Count |
|
| Stereochemistry | MIXED |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 2 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| 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 10:48:41 UTC 2023
by
admin
on
Sat Dec 16 10:48:41 UTC 2023
|
| Record UNII |
63BCJ5R11D
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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63BCJ5R11D
Created by
admin on Sat Dec 16 10:48:41 UTC 2023 , Edited by admin on Sat Dec 16 10:48:41 UTC 2023
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PRIMARY | |||
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DTXSID10362202
Created by
admin on Sat Dec 16 10:48:41 UTC 2023 , Edited by admin on Sat Dec 16 10:48:41 UTC 2023
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6033-08-5
Created by
admin on Sat Dec 16 10:48:41 UTC 2023 , Edited by admin on Sat Dec 16 10:48:41 UTC 2023
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PRIMARY | |||
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m5941
Created by
admin on Sat Dec 16 10:48:41 UTC 2023 , Edited by admin on Sat Dec 16 10:48:41 UTC 2023
|
PRIMARY | Merck Index |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
ANHYDROUS->SOLVATE |
