Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C27H36N2O5.BrH |
| Molecular Weight | 549.497 |
| Optical Activity | ( + ) |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
Br.COC1=C(OC)C=C2[C@@H](CN(C)CCCN3CCC4=CC(OC)=C(OC)C=C4CC3=O)CC2=C1
InChI
InChIKey=ZVSIMBFKBQCPEX-ZMBIFBSDSA-N
InChI=1S/C27H36N2O5.BrH/c1-28(17-21-11-20-14-25(33-4)26(34-5)16-22(20)21)8-6-9-29-10-7-18-12-23(31-2)24(32-3)13-19(18)15-27(29)30;/h12-14,16,21H,6-11,15,17H2,1-5H3;1H/t21-;/m1./s1
| Molecular Formula | BrH |
| Molecular Weight | 80.912 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C27H36N2O5 |
| Molecular Weight | 468.5851 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 18:17:17 UTC 2023
by
admin
on
Sat Dec 16 18:17:17 UTC 2023
|
| Record UNII |
XS8A2GK8EV
|
| Record Status |
Validated (UNII)
|
| Record Version |
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-
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44250717
Created by
admin on Sat Dec 16 18:17:17 UTC 2023 , Edited by admin on Sat Dec 16 18:17:17 UTC 2023
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XS8A2GK8EV
Created by
admin on Sat Dec 16 18:17:17 UTC 2023 , Edited by admin on Sat Dec 16 18:17:17 UTC 2023
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100000165749
Created by
admin on Sat Dec 16 18:17:17 UTC 2023 , Edited by admin on Sat Dec 16 18:17:17 UTC 2023
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1190604-70-6
Created by
admin on Sat Dec 16 18:17:17 UTC 2023 , Edited by admin on Sat Dec 16 18:17:17 UTC 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> SALT/SOLVATE |
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| Related Record | Type | Details | ||
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ACTIVE MOIETY |
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