Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C40H46N4O2.2Cl |
| Molecular Weight | 685.725 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 10 / 10 |
| E/Z Centers | 2 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[Cl-].[Cl-].C[N@@+]12CC[C@@]34[C@@H]1C[C@H](C5=CN6[C@H]7C(=CN([C@H]35)C8=C4C=CC=C8)[C@H]9C[C@H]%10[C@@]7(CC[N@@+]%10(C)C\C9=C\CO)C%11=C6C=CC=C%11)\C(C2)=C/CO
InChI
InChIKey=UAMHUVZCGJSLHZ-UOXMBZERSA-L
InChI=1S/C40H46N4O2.2ClH/c1-43-15-13-39-31-7-3-5-9-33(31)41-22-30-28-20-36-40(14-16-44(36,2)24-26(28)12-18-46)32-8-4-6-10-34(32)42(38(30)40)21-29(37(39)41)27(19-35(39)43)25(23-43)11-17-45;;/h3-12,21-22,27-28,35-38,45-46H,13-20,23-24H2,1-2H3;2*1H/q+2;;/p-2/b25-11-,26-12-,29-21-,30-22-;;/t27-,28-,35-,36-,37-,38-,39+,40+,43-,44-;;/m0../s1
| Molecular Formula | C40H44N4O2 |
| Molecular Weight | 612.803 |
| Charge | 0 |
| Count |
|
| Stereochemistry | MIXED |
| Additional Stereochemistry | No |
| Defined Stereocenters | 8 / 10 |
| E/Z Centers | 2 |
| 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
Mon Mar 31 22:48:50 GMT 2025
by
admin
on
Mon Mar 31 22:48:50 GMT 2025
|
| Record UNII |
4JD1SM99QN
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
| Name | Type | Language | ||
|---|---|---|---|---|
|
Preferred Name | English | ||
|
Common Name | English | ||
|
Common Name | English | ||
|
Common Name | English |
| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
|
4JD1SM99QN
Created by
admin on Mon Mar 31 22:48:50 GMT 2025 , Edited by admin on Mon Mar 31 22:48:50 GMT 2025
|
PRIMARY | |||
|
44345588
Created by
admin on Mon Mar 31 22:48:50 GMT 2025 , Edited by admin on Mon Mar 31 22:48:50 GMT 2025
|
PRIMARY | |||
|
m10987
Created by
admin on Mon Mar 31 22:48:50 GMT 2025 , Edited by admin on Mon Mar 31 22:48:50 GMT 2025
|
PRIMARY | Merck Index | ||
|
6696-58-8
Created by
admin on Mon Mar 31 22:48:50 GMT 2025 , Edited by admin on Mon Mar 31 22:48:50 GMT 2025
|
PRIMARY |