Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C40H63N9O8S |
| Molecular Weight | 830.049 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 8 / 8 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[H][C@]1(NC(=O)[C@@H](NC(=O)[C@@H](CC2=CNC3=C2C=CC=C3)NC(=O)CCSCC[C@H](NC(=O)[C@H](CC(N)=O)NC1=O)C(=O)N(C)[C@H](CO)CCCN)[C@@H](C)CC)[C@H](C)CC
InChI
InChIKey=UGNGRKKDUVKQDF-IHOMMZCZSA-N
InChI=1S/C40H63N9O8S/c1-6-23(3)34-38(55)46-31(20-32(42)51)36(53)45-29(40(57)49(5)26(22-50)11-10-16-41)14-17-58-18-15-33(52)44-30(19-25-21-43-28-13-9-8-12-27(25)28)37(54)47-35(24(4)7-2)39(56)48-34/h8-9,12-13,21,23-24,26,29-31,34-35,43,50H,6-7,10-11,14-20,22,41H2,1-5H3,(H2,42,51)(H,44,52)(H,45,53)(H,46,55)(H,47,54)(H,48,56)/t23-,24+,26+,29+,30-,31+,34+,35+/m1/s1
| Molecular Formula | C40H63N9O8S |
| Molecular Weight | 830.049 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 8 / 8 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Barusiban, a long-acting oxytocin antagonist, has been studied to stop preterm labor in pregnant women at late gestational age. The experiments failed to demonstrate the effectiveness and were discontinued. However, barusiban participates in phase II clinical trials for female infertility.
Originator
Approval Year
Sample Use Guides
preterm labor: single intravenous bolus of barusiban (0.3, 1, 3, or 10 mg)
In Vitro Fertilisation (IVF) Treatment: IV bolus of 20 mg for 1 minute followed by an IV infusion of 19 mg for up to 59 minutes. The maximum total duration of administration was 60 minutes.
Route of Administration:
Intravenous
| Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 16:14:27 GMT 2023
by
admin
on
Fri Dec 15 16:14:27 GMT 2023
|
| Record UNII |
UX33I93GLS
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
Download
| Name | Type | Language | ||
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Official Name | English | ||
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Common Name | English | ||
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Common Name | English |
| Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C98292
Created by
admin on Fri Dec 15 16:14:28 GMT 2023 , Edited by admin on Fri Dec 15 16:14:28 GMT 2023
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| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
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Barusiban
Created by
admin on Fri Dec 15 16:14:28 GMT 2023 , Edited by admin on Fri Dec 15 16:14:28 GMT 2023
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CHEMBL2218898
Created by
admin on Fri Dec 15 16:14:27 GMT 2023 , Edited by admin on Fri Dec 15 16:14:27 GMT 2023
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UX33I93GLS
Created by
admin on Fri Dec 15 16:14:27 GMT 2023 , Edited by admin on Fri Dec 15 16:14:27 GMT 2023
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C517339
Created by
admin on Fri Dec 15 16:14:28 GMT 2023 , Edited by admin on Fri Dec 15 16:14:28 GMT 2023
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DB12292
Created by
admin on Fri Dec 15 16:14:27 GMT 2023 , Edited by admin on Fri Dec 15 16:14:27 GMT 2023
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285571-64-4
Created by
admin on Fri Dec 15 16:14:27 GMT 2023 , Edited by admin on Fri Dec 15 16:14:27 GMT 2023
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8252
Created by
admin on Fri Dec 15 16:14:27 GMT 2023 , Edited by admin on Fri Dec 15 16:14:27 GMT 2023
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PRIMARY | |||
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DTXSID20182771
Created by
admin on Fri Dec 15 16:14:27 GMT 2023 , Edited by admin on Fri Dec 15 16:14:27 GMT 2023
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PRIMARY | |||
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C90866
Created by
admin on Fri Dec 15 16:14:28 GMT 2023 , Edited by admin on Fri Dec 15 16:14:28 GMT 2023
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9832431
Created by
admin on Fri Dec 15 16:14:28 GMT 2023 , Edited by admin on Fri Dec 15 16:14:28 GMT 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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TARGET -> INHIBITOR |
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE MOIETY |
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