Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C60H84N2O8 |
| Molecular Weight | 961.3176 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 14 / 14 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[H][C@@]12OC3=C4C(C[C@H]5N(CC6CC6)CC[C@@]14[C@@]57CC[C@@]2(OC)[C@]([H])(C7)[C@](C)(O)C(C)(C)C)=CC=C3OCCOC8=CC=C9C[C@H]%10N(CC%11CC%11)CC[C@]%12%13C9=C8O[C@@]%12([H])[C@]%14(CC[C@@]%10%13C[C@]%14([H])[C@](C)(O)C(C)(C)C)OC
InChI
InChIKey=LEQOVFCHMOTJKU-WJVXOHEGSA-N
InChI=1S/C60H84N2O8/c1-51(2,3)53(7,63)41-31-55-19-21-59(41,65-9)49-57(55)23-25-61(33-35-11-12-35)43(55)29-37-15-17-39(47(69-49)45(37)57)67-27-28-68-40-18-16-38-30-44-56-20-22-60(66-10,42(32-56)54(8,64)52(4,5)6)50-58(56,46(38)48(40)70-50)24-26-62(44)34-36-13-14-36/h15-18,35-36,41-44,49-50,63-64H,11-14,19-34H2,1-10H3/t41-,42-,43-,44-,49-,50-,53+,54+,55-,56-,57+,58+,59-,60-/m1/s1
| Molecular Formula | C60H84N2O8 |
| Molecular Weight | 961.3176 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 14 / 14 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 14:02:19 GMT 2023
by
admin
on
Sat Dec 16 14:02:19 GMT 2023
|
| Record UNII |
SE6KE496VO
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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| Name | Type | Language | ||
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Common Name | English |
| Code System | Code | Type | Description | ||
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1820753-68-1
Created by
admin on Sat Dec 16 14:02:19 GMT 2023 , Edited by admin on Sat Dec 16 14:02:19 GMT 2023
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PRIMARY | |||
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SE6KE496VO
Created by
admin on Sat Dec 16 14:02:19 GMT 2023 , Edited by admin on Sat Dec 16 14:02:19 GMT 2023
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PRIMARY | |||
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92042890
Created by
admin on Sat Dec 16 14:02:19 GMT 2023 , Edited by admin on Sat Dec 16 14:02:19 GMT 2023
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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TARGET -> AGONIST |
Ki
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE MOIETY |
