Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C44H73N13O13 |
| Molecular Weight | 992.1297 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 11 / 11 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC(C)C[C@@H]1NC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CCN)NC(=O)[C@H](CCNC(=O)[C@@H](NC(=O)[C@H](CCN)NC(=O)[C@H](CCN)NC1=O)[C@@H](C)O)NC(=O)[C@@H](CO)NC(=O)[C@@H](NC(C)=O)[C@@H](C)O
InChI
InChIKey=JBFNEVNUGGFPBQ-DDMCRLCFSA-N
InChI=1S/C44H73N13O13/c1-22(2)19-31-40(66)52-27(11-15-45)36(62)51-29(13-17-47)39(65)57-34(23(3)59)43(69)48-18-14-30(53-42(68)33(21-58)56-44(70)35(24(4)60)49-25(5)61)38(64)50-28(12-16-46)37(63)55-32(41(67)54-31)20-26-9-7-6-8-10-26/h6-10,22-24,27-35,58-60H,11-21,45-47H2,1-5H3,(H,48,69)(H,49,61)(H,50,64)(H,51,62)(H,52,66)(H,53,68)(H,54,67)(H,55,63)(H,56,70)(H,57,65)/t23-,24-,27+,28+,29+,30+,31+,32-,33-,34+,35+/m1/s1
| Molecular Formula | C45H75N13O13 |
| Molecular Weight | 1006.1563 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 11 / 11 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Wed Apr 02 19:34:10 GMT 2025
by
admin
on
Wed Apr 02 19:34:10 GMT 2025
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| Record UNII |
XQ4XZ5Y4KE
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| Record Status |
Validated (UNII)
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| Record Version |
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-
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Preferred Name | English | ||
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53323381
Created by
admin on Wed Apr 02 19:34:10 GMT 2025 , Edited by admin on Wed Apr 02 19:34:10 GMT 2025
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XQ4XZ5Y4KE
Created by
admin on Wed Apr 02 19:34:10 GMT 2025 , Edited by admin on Wed Apr 02 19:34:10 GMT 2025
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1179330-52-9
Created by
admin on Wed Apr 02 19:34:10 GMT 2025 , Edited by admin on Wed Apr 02 19:34:10 GMT 2025
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300000042539
Created by
admin on Wed Apr 02 19:34:10 GMT 2025 , Edited by admin on Wed Apr 02 19:34:10 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
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TARGET -> ACTIVATOR |
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SALT/SOLVATE -> PARENT |
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| Related Record | Type | Details | ||
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ACTIVE MOIETY |
A novel polymyxin B (PMB) analogue shown to potentiate several large-scaffold antibiotics in Gram-negative pathogens.
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