Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C28H35N5O4.C4H6O6 |
Molecular Weight | 655.6954 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 4 / 4 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
O[C@H]([C@@H](O)C(O)=O)C(O)=O.CN1N=C2CCN(C[C@@]2(CC3=CC=CC=C3)C1=O)C(=O)[C@@H](COCC4=CC=CC=C4)NC(=O)C(C)(C)N
InChI
InChIKey=MJGRJCMGMFLOET-MYPSAZMDSA-N
InChI=1S/C28H35N5O4.C4H6O6/c1-27(2,29)25(35)30-22(18-37-17-21-12-8-5-9-13-21)24(34)33-15-14-23-28(19-33,26(36)32(3)31-23)16-20-10-6-4-7-11-20;5-1(3(7)8)2(6)4(9)10/h4-13,22H,14-19,29H2,1-3H3,(H,30,35);1-2,5-6H,(H,7,8)(H,9,10)/t22-,28-;1-,2-/m11/s1
Molecular Formula | C4H6O6 |
Molecular Weight | 150.0868 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Molecular Formula | C28H35N5O4 |
Molecular Weight | 505.6086 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 16:18:25 UTC 2023
by
admin
on
Fri Dec 15 16:18:25 UTC 2023
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Record UNII |
4150VMF5EP
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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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NCI_THESAURUS |
C76358
Created by
admin on Fri Dec 15 16:18:25 UTC 2023 , Edited by admin on Fri Dec 15 16:18:25 UTC 2023
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Code System | Code | Type | Description | ||
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300000033570
Created by
admin on Fri Dec 15 16:18:25 UTC 2023 , Edited by admin on Fri Dec 15 16:18:25 UTC 2023
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9852610
Created by
admin on Fri Dec 15 16:18:25 UTC 2023 , Edited by admin on Fri Dec 15 16:18:25 UTC 2023
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1986788
Created by
admin on Fri Dec 15 16:18:25 UTC 2023 , Edited by admin on Fri Dec 15 16:18:25 UTC 2023
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193273-69-7
Created by
admin on Fri Dec 15 16:18:25 UTC 2023 , Edited by admin on Fri Dec 15 16:18:25 UTC 2023
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m11965
Created by
admin on Fri Dec 15 16:18:25 UTC 2023 , Edited by admin on Fri Dec 15 16:18:25 UTC 2023
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KK-100
Created by
admin on Fri Dec 15 16:18:25 UTC 2023 , Edited by admin on Fri Dec 15 16:18:25 UTC 2023
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DTXSID60941001
Created by
admin on Fri Dec 15 16:18:25 UTC 2023 , Edited by admin on Fri Dec 15 16:18:25 UTC 2023
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4150VMF5EP
Created by
admin on Fri Dec 15 16:18:25 UTC 2023 , Edited by admin on Fri Dec 15 16:18:25 UTC 2023
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PRIMARY | |||
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C78756
Created by
admin on Fri Dec 15 16:18:25 UTC 2023 , Edited by admin on Fri Dec 15 16:18:25 UTC 2023
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4150VMF5EP
Created by
admin on Fri Dec 15 16:18:25 UTC 2023 , Edited by admin on Fri Dec 15 16:18:25 UTC 2023
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PRIMARY |
Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE | |||
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PARENT -> SALT/SOLVATE |
Related Record | Type | Details | ||
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ACTIVE MOIETY |