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-].[H][C@]12C[C@]3([H])C4=CN5C6=CC=CC=C6[C@]78CC[N@@+]9(C)C\C(=C\CO)[C@]([H])(C[C@@]79[H])C(=CN%10C%11=CC=CC=C%11[C@@]1(CC[N@@+]2(C)C\C3=C\CO)[C@]4%10[H])[C@]58[H]
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 | ClH |
| Molecular Weight | 36.461 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| 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 |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 09:42:41 GMT 2023
by
admin
on
Sat Dec 16 09:42:41 GMT 2023
|
| Record UNII |
4JD1SM99QN
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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4JD1SM99QN
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admin on Sat Dec 16 09:42:41 GMT 2023 , Edited by admin on Sat Dec 16 09:42:41 GMT 2023
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44345588
Created by
admin on Sat Dec 16 09:42:41 GMT 2023 , Edited by admin on Sat Dec 16 09:42:41 GMT 2023
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m10987
Created by
admin on Sat Dec 16 09:42:41 GMT 2023 , Edited by admin on Sat Dec 16 09:42:41 GMT 2023
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6696-58-8
Created by
admin on Sat Dec 16 09:42:41 GMT 2023 , Edited by admin on Sat Dec 16 09:42:41 GMT 2023
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