Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C58H66N10O9.2C4H7NO4 |
Molecular Weight | 1313.4116 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 9 / 9 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
N[C@@H](CC(O)=O)C(O)=O.N[C@@H](CC(O)=O)C(O)=O.[H][C@@]12C[C@H](CN1C(=O)[C@H](CC3=CC=CC=C3)NC(=O)[C@H](CC4=CC=C(OCC5=CC=CC=C5)C=C4)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](CC6=CNC7=C6C=CC=C7)NC(=O)[C@@H](NC2=O)C8=CC=CC=C8)OC(=O)NCCN
InChI
InChIKey=NEEFMPSSNFRRNC-HQUONIRXSA-N
InChI=1S/C58H66N10O9.2C4H7NO4/c59-27-13-12-22-46-52(69)64-47(30-38-23-25-42(26-24-38)76-36-39-16-6-2-7-17-39)53(70)66-49(31-37-14-4-1-5-15-37)57(74)68-35-43(77-58(75)61-29-28-60)33-50(68)55(72)67-51(40-18-8-3-9-19-40)56(73)65-48(54(71)63-46)32-41-34-62-45-21-11-10-20-44(41)45;2*5-2(4(8)9)1-3(6)7/h1-11,14-21,23-26,34,43,46-51,62H,12-13,22,27-33,35-36,59-60H2,(H,61,75)(H,63,71)(H,64,69)(H,65,73)(H,66,70)(H,67,72);2*2H,1,5H2,(H,6,7)(H,8,9)/t43-,46+,47+,48-,49+,50+,51+;2*2-/m100/s1
Molecular Formula | C58H66N10O9 |
Molecular Weight | 1047.2062 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 7 / 7 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Molecular Formula | C4H7NO4 |
Molecular Weight | 133.1027 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 18:32:03 UTC 2023
by
admin
on
Sat Dec 16 18:32:03 UTC 2023
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Record UNII |
I4P76SY3N4
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Record Status |
Validated (UNII)
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Record Version |
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-
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Classification Tree | Code System | Code | ||
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EMA ASSESSMENT REPORTS |
SIGNIFOR (AUTHORIZED: PITUITARY ACTH HYPERSECRETION)
Created by
admin on Sat Dec 16 18:32:04 UTC 2023 , Edited by admin on Sat Dec 16 18:32:04 UTC 2023
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EMA ASSESSMENT REPORTS |
SIGNIFOR (AUTHORIZED: ACROMEGALY)
Created by
admin on Sat Dec 16 18:32:04 UTC 2023 , Edited by admin on Sat Dec 16 18:32:04 UTC 2023
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SUB71450
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396091-77-3
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admin on Sat Dec 16 18:32:04 UTC 2023 , Edited by admin on Sat Dec 16 18:32:04 UTC 2023
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NON-SPECIFIC STOICHIOMETRY | |||
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DBSALT000134
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1364104
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admin on Sat Dec 16 18:32:04 UTC 2023 , Edited by admin on Sat Dec 16 18:32:04 UTC 2023
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70788982
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admin on Sat Dec 16 18:32:04 UTC 2023 , Edited by admin on Sat Dec 16 18:32:04 UTC 2023
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100000135680
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admin on Sat Dec 16 18:32:04 UTC 2023 , Edited by admin on Sat Dec 16 18:32:04 UTC 2023
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I4P76SY3N4
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admin on Sat Dec 16 18:32:04 UTC 2023 , Edited by admin on Sat Dec 16 18:32:04 UTC 2023
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820232-50-6
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admin on Sat Dec 16 18:32:04 UTC 2023 , Edited by admin on Sat Dec 16 18:32:04 UTC 2023
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CHEMBL3039583
Created by
admin on Sat Dec 16 18:32:04 UTC 2023 , Edited by admin on Sat Dec 16 18:32:04 UTC 2023
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72313
Created by
admin on Sat Dec 16 18:32:04 UTC 2023 , Edited by admin on Sat Dec 16 18:32:04 UTC 2023
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DTXSID40231533
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admin on Sat Dec 16 18:32:04 UTC 2023 , Edited by admin on Sat Dec 16 18:32:04 UTC 2023
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Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE |
Related Record | Type | Details | ||
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ACTIVE MOIETY |