Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C53H88N4O51S8 |
| Molecular Weight | 1853.782 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 28 / 28 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[H][C@]12CS[C@@H](CCCCC(=O)NCCCCCC(=O)N[C@H]3[C@@H](O[C@@]4([H])[C@H](OC)[C@@H](OC)[C@H](O[C@]5([H])[C@@H](COS(O)(=O)=O)O[C@H](O[C@@]6([H])[C@H](OC)[C@@H](OC)[C@H](O[C@]7([H])[C@@H](COS(O)(=O)=O)O[C@H](OC)[C@H](OS(O)(=O)=O)[C@H]7OS(O)(=O)=O)O[C@H]6C(O)=O)[C@H](OS(O)(=O)=O)[C@H]5OS(O)(=O)=O)O[C@@H]4C(O)=O)O[C@H](COS(O)(=O)=O)[C@@H](OC)[C@@H]3OC)[C@@]1([H])NC(=O)N2
InChI
InChIKey=MUQWDYYIYNYBQD-OFHININYSA-N
InChI=1S/C53H88N4O51S8/c1-86-30-22(17-93-110(65,66)67)96-48(29(33(30)87-2)56-27(59)15-9-8-12-16-54-26(58)14-11-10-13-25-28-21(20-109-25)55-53(64)57-28)101-36-34(88-3)42(90-5)50(103-40(36)46(60)61)100-32-24(19-95-112(71,72)73)98-52(45(108-116(83,84)85)39(32)106-114(77,78)79)102-37-35(89-4)43(91-6)51(104-41(37)47(62)63)99-31-23(18-94-111(68,69)70)97-49(92-7)44(107-115(80,81)82)38(31)105-113(74,75)76/h21-25,28-45,48-52H,8-20H2,1-7H3,(H,54,58)(H,56,59)(H,60,61)(H,62,63)(H2,55,57,64)(H,65,66,67)(H,68,69,70)(H,71,72,73)(H,74,75,76)(H,77,78,79)(H,80,81,82)(H,83,84,85)/t21-,22+,23+,24+,25-,28-,29+,30+,31+,32+,33+,34-,35-,36-,37-,38-,39-,40-,41+,42+,43+,44+,45+,48+,49-,50+,51+,52+/m0/s1
| Molecular Formula | C53H88N4O51S8 |
| Molecular Weight | 1853.782 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 28 / 28 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Idrabiotaparinux, a biotinylated idraparinux, was developed by Sanofi as a long-acting inhibitor of factor Xa. Idrabiotaparinux participated in clinical trials phase III to prevent stroke and systemic thromboembolic events in patients with atrial fibrillation. The study was prematurely terminated, because of unknown reason. In addition, the drug was involved in phase II for patients with pulmonary embolism. Sanofi has discontinued development of idrabiotaparinux.
Originator
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 10:09:33 UTC 2023
by
admin
on
Sat Dec 16 10:09:33 UTC 2023
|
| Record UNII |
H44R6RJT3S
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
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100000175130
Created by
admin on Sat Dec 16 10:09:33 UTC 2023 , Edited by admin on Sat Dec 16 10:09:33 UTC 2023
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774531-07-6
Created by
admin on Sat Dec 16 10:09:33 UTC 2023 , Edited by admin on Sat Dec 16 10:09:33 UTC 2023
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H44R6RJT3S
Created by
admin on Sat Dec 16 10:09:33 UTC 2023 , Edited by admin on Sat Dec 16 10:09:33 UTC 2023
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16202213
Created by
admin on Sat Dec 16 10:09:33 UTC 2023 , Edited by admin on Sat Dec 16 10:09:33 UTC 2023
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| Related Record | Type | Details | ||
|---|---|---|---|---|
|
BINDER->LIGAND |
CAN NEUTRALIZE IDRABIOTAPARINUX
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SALT/SOLVATE -> PARENT | |||
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TARGET -> INHIBITOR |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE MOIETY |
