Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C58H105N16O28S5.5Na |
| Molecular Weight | 1749.819 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 13 / 13 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[Na+].[Na+].[Na+].[Na+].[Na+].CC[C@H](C)CCCCC(=O)N[C@@H](CCNCS([O-])(=O)=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CCNCS([O-])(=O)=O)C(=O)N[C@H]1CCNC(=O)[C@@H](NC(=O)[C@H](CCNCS([O-])(=O)=O)NC(=O)[C@H](CCNCS([O-])(=O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](CCNCS([O-])(=O)=O)NC1=O)[C@@H](C)O
InChI
InChIKey=IQWHCHZFYPIVRV-VVXJTWMDSA-I
InChI=1S/C58H110N16O28S5.5Na/c1-9-35(6)12-10-11-13-46(77)65-38(14-20-59-28-103(88,89)90)53(82)74-48(37(8)76)58(87)70-41(17-23-62-31-106(97,98)99)50(79)68-43-19-25-64-57(86)47(36(7)75)73-54(83)42(18-24-63-32-107(100,101)102)67-49(78)39(15-21-60-29-104(91,92)93)69-55(84)44(26-33(2)3)72-56(85)45(27-34(4)5)71-52(81)40(66-51(43)80)16-22-61-30-105(94,95)96;;;;;/h33-45,47-48,59-63,75-76H,9-32H2,1-8H3,(H,64,86)(H,65,77)(H,66,80)(H,67,78)(H,68,79)(H,69,84)(H,70,87)(H,71,81)(H,72,85)(H,73,83)(H,74,82)(H,88,89,90)(H,91,92,93)(H,94,95,96)(H,97,98,99)(H,100,101,102);;;;;/q;5*+1/p-5/t35-,36+,37+,38-,39-,40-,41-,42-,43-,44-,45+,47-,48-;;;;;/m0...../s1
| Molecular Formula | Na |
| Molecular Weight | 22.98976928 |
| Charge | 1 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C58H105N16O28S5 |
| Molecular Weight | 1634.87 |
| Charge | -5 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 13 / 13 |
| E/Z Centers | 3 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 18:30:33 GMT 2025
by
admin
on
Mon Mar 31 18:30:33 GMT 2025
|
| Record UNII |
0REB5D8ERB
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
| Name | Type | Language | ||
|---|---|---|---|---|
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Common Name | English | ||
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Preferred Name | English | ||
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Common Name | English |
| Classification Tree | Code System | Code | ||
|---|---|---|---|---|
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NCI_THESAURUS |
C78160
Created by
admin on Mon Mar 31 18:30:33 GMT 2025 , Edited by admin on Mon Mar 31 18:30:33 GMT 2025
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| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
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66571288
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PRIMARY | |||
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DTXSID00179447
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admin on Mon Mar 31 18:30:33 GMT 2025 , Edited by admin on Mon Mar 31 18:30:33 GMT 2025
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PRIMARY | |||
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SUB06801MIG
Created by
admin on Mon Mar 31 18:30:33 GMT 2025 , Edited by admin on Mon Mar 31 18:30:33 GMT 2025
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PRIMARY | |||
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24708-58-5
Created by
admin on Mon Mar 31 18:30:33 GMT 2025 , Edited by admin on Mon Mar 31 18:30:33 GMT 2025
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PRIMARY | |||
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0REB5D8ERB
Created by
admin on Mon Mar 31 18:30:33 GMT 2025 , Edited by admin on Mon Mar 31 18:30:33 GMT 2025
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PRIMARY | |||
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C75974
Created by
admin on Mon Mar 31 18:30:33 GMT 2025 , Edited by admin on Mon Mar 31 18:30:33 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
|
PARENT -> SALT/SOLVATE |