Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C31H32N4O4.C4H6O4 |
| Molecular Weight | 642.6982 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)CCC(O)=O.CC(C)(CC1=CC=C(OC2=CC=C(C=N2)C(N)=O)C=C1)NC[C@H](O)COC3=CC=CC4=C3C5=C(N4)C=CC=C5
InChI
InChIKey=VETOWAAOXIOBAQ-FTBISJDPSA-N
InChI=1S/C31H32N4O4.C4H6O4/c1-31(2,16-20-10-13-23(14-11-20)39-28-15-12-21(17-33-28)30(32)37)34-18-22(36)19-38-27-9-5-8-26-29(27)24-6-3-4-7-25(24)35-26;5-3(6)1-2-4(7)8/h3-15,17,22,34-36H,16,18-19H2,1-2H3,(H2,32,37);1-2H2,(H,5,6)(H,7,8)/t22-;/m0./s1
| Molecular Formula | C4H6O4 |
| Molecular Weight | 118.088 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C31H32N4O4 |
| Molecular Weight | 524.6102 |
| 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
Fri Dec 15 15:55:34 UTC 2023
by
admin
on
Fri Dec 15 15:55:34 UTC 2023
|
| Record UNII |
E9VKF1I67D
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
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DTXSID30174420
Created by
admin on Fri Dec 15 15:55:34 UTC 2023 , Edited by admin on Fri Dec 15 15:55:34 UTC 2023
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204593-36-2
Created by
admin on Fri Dec 15 15:55:34 UTC 2023 , Edited by admin on Fri Dec 15 15:55:34 UTC 2023
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16081026
Created by
admin on Fri Dec 15 15:55:34 UTC 2023 , Edited by admin on Fri Dec 15 15:55:34 UTC 2023
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E9VKF1I67D
Created by
admin on Fri Dec 15 15:55:34 UTC 2023 , Edited by admin on Fri Dec 15 15:55:34 UTC 2023
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PRIMARY |
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PARENT -> SALT/SOLVATE | |||
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PARENT -> SALT/SOLVATE |
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ACTIVE MOIETY |