Details
| Stereochemistry | EPIMERIC |
| Molecular Formula | C30H39N7O9S |
| Molecular Weight | 673.737 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 4 / 5 |
| E/Z Centers | 0 |
| Charge | 0 |
| Stereo Comments | Assumed epimeric |
SHOW SMILES / InChI
SMILES
C[S+]([O-])CC[C@@H](NC(=O)[C@@H](N)CC1=CC=C(O)C=C1)C(=O)NCC(=O)N[C@@H](CC2=CC=C(C=C2)[N+]([O-])=O)C(=O)N3CCC[C@H]3C(N)=O
InChI
InChIKey=GZNCHAAJGRIQGO-UCJAIZFTSA-N
InChI=1S/C30H39N7O9S/c1-47(46)14-12-23(35-28(41)22(31)15-18-6-10-21(38)11-7-18)29(42)33-17-26(39)34-24(16-19-4-8-20(9-5-19)37(44)45)30(43)36-13-2-3-25(36)27(32)40/h4-11,22-25,38H,2-3,12-17,31H2,1H3,(H2,32,40)(H,33,42)(H,34,39)(H,35,41)/t22-,23+,24-,25-,47?/m0/s1
| Molecular Formula | C30H39N7O9S |
| Molecular Weight | 673.737 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 4 / 4 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 09:04:38 UTC 2023
by
admin
on
Sat Dec 16 09:04:38 UTC 2023
|
| Record UNII |
7ATC8US66S
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
| Name | Type | Language | ||
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Code | English | ||
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Common Name | English | ||
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Systematic Name | English | ||
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Systematic Name | English | ||
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Brand Name | English |
| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
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73385-60-1
Created by
admin on Sat Dec 16 09:04:38 UTC 2023 , Edited by admin on Sat Dec 16 09:04:38 UTC 2023
|
PRIMARY | |||
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DTXSID50994102
Created by
admin on Sat Dec 16 09:04:38 UTC 2023 , Edited by admin on Sat Dec 16 09:04:38 UTC 2023
|
PRIMARY | |||
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7ATC8US66S
Created by
admin on Sat Dec 16 09:04:38 UTC 2023 , Edited by admin on Sat Dec 16 09:04:38 UTC 2023
|
PRIMARY | |||
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6442055
Created by
admin on Sat Dec 16 09:04:38 UTC 2023 , Edited by admin on Sat Dec 16 09:04:38 UTC 2023
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
SALT/SOLVATE -> PARENT | |||
|
TARGET -> AGONIST |
Dissociation constants (K,) of BW942C toward multiple opioid receptors in guinea pig brain
BINDING
Ki
|
||
|
TARGET->PARTIAL AGONIST |
BINDING
Ki
|
||
|
SALT/SOLVATE -> PARENT | |||
|
TARGET -> AGONIST |
Dissociation constants (K,) of BW942C toward multiple opioid receptors in guinea pig brain
BINDING
Ki
|
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
ACTIVE MOIETY |
