Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C60H87N19O13 |
Molecular Weight | 1282.4523 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 10 / 10 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
N[C@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@H]1C(=O)N2C[C@H](O)C[C@H]2C(=O)NCC(=O)N[C@@H](CC3=CC=CC=C3)C(=O)N[C@@H](CO)C(=O)N[C@H](CC4=CC=CC=C4)C(=O)N[C@@H](CC5=CC=CC=C5)C(=O)N[C@@H](CCCNC(N)=N)C(O)=O
InChI
InChIKey=RBIXVHPHNGXTCI-QJTYZATASA-N
InChI=1S/C60H87N19O13/c61-39(20-10-24-68-58(62)63)49(83)73-40(21-11-25-69-59(64)65)55(89)78-27-13-23-46(78)56(90)79-33-38(81)31-47(79)54(88)71-32-48(82)72-42(28-35-14-4-1-5-15-35)50(84)77-45(34-80)53(87)76-44(30-37-18-8-3-9-19-37)52(86)75-43(29-36-16-6-2-7-17-36)51(85)74-41(57(91)92)22-12-26-70-60(66)67/h1-9,14-19,38-47,80-81H,10-13,20-34,61H2,(H,71,88)(H,72,82)(H,73,83)(H,74,85)(H,75,86)(H,76,87)(H,77,84)(H,91,92)(H4,62,63,68)(H4,64,65,69)(H4,66,67,70)/t38-,39-,40+,41+,42+,43+,44-,45+,46+,47+/m1/s1
Molecular Formula | C60H87N19O13 |
Molecular Weight | 1282.4523 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 10 / 10 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 19:39:54 UTC 2023
by
admin
on
Fri Dec 15 19:39:54 UTC 2023
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Record UNII |
DV64B0PLEH
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Record Status |
Validated (UNII)
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Record Version |
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-
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Code | English | ||
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Systematic Name | English |
Code System | Code | Type | Description | ||
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73294
Created by
admin on Fri Dec 15 19:39:54 UTC 2023 , Edited by admin on Fri Dec 15 19:39:54 UTC 2023
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PRIMARY | |||
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DV64B0PLEH
Created by
admin on Fri Dec 15 19:39:54 UTC 2023 , Edited by admin on Fri Dec 15 19:39:54 UTC 2023
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119343
Created by
admin on Fri Dec 15 19:39:54 UTC 2023 , Edited by admin on Fri Dec 15 19:39:54 UTC 2023
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109333-26-8
Created by
admin on Fri Dec 15 19:39:54 UTC 2023 , Edited by admin on Fri Dec 15 19:39:54 UTC 2023
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PRIMARY |
Related Record | Type | Details | ||
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TARGET -> INHIBITOR |
Binding Assay
IC50
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Related Record | Type | Details | ||
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ACTIVE MOIETY |
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