Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C45H54F2N4O8.2C4H6O6 |
Molecular Weight | 1117.1027 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 14 / 14 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
O[C@H]([C@@H](O)C(O)=O)C(O)=O.O[C@H]([C@@H](O)C(O)=O)C(O)=O.[H][C@@]12N3CC[C@@]14C5=C(C=C(OC)C(=C5)[C@]6(C[C@@H]7C[C@H](C[N@@](C7)CC8=C6NC9=C8C=CC=C9)C(C)(F)F)C(=O)OC)N(C)[C@@]4([H])[C@](O)([C@H](OC(C)=O)[C@]2(CC)C=CC3)C(=O)OC
InChI
InChIKey=YIHUEPHBPPAAHH-IIQAEXPMSA-N
InChI=1S/C45H54F2N4O8.2C4H6O6/c1-8-42-14-11-16-51-17-15-43(36(42)51)30-19-31(34(56-5)20-33(30)49(4)37(43)45(55,40(54)58-7)38(42)59-25(2)52)44(39(53)57-6)21-26-18-27(41(3,46)47)23-50(22-26)24-29-28-12-9-10-13-32(28)48-35(29)44;2*5-1(3(7)8)2(6)4(9)10/h9-14,19-20,26-27,36-38,48,55H,8,15-18,21-24H2,1-7H3;2*1-2,5-6H,(H,7,8)(H,9,10)/t26-,27+,36-,37+,38+,42+,43+,44-,45-;2*1-,2-/m011/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 | C45H54F2N4O8 |
Molecular Weight | 816.9291 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 8 / 9 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 15:45:44 UTC 2023
by
admin
on
Fri Dec 15 15:45:44 UTC 2023
|
Record UNII |
33MG53C7XW
|
Record Status |
Validated (UNII)
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Record Version |
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-
Download
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Official Name | English | ||
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Common Name | English | ||
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Code | English | ||
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Code | English | ||
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Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C67422
Created by
admin on Fri Dec 15 15:45:44 UTC 2023 , Edited by admin on Fri Dec 15 15:45:44 UTC 2023
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EMA ASSESSMENT REPORTS |
JAVLOR (AUTHORIZED: UROLOGIC NEOPLASMS)
Created by
admin on Fri Dec 15 15:45:44 UTC 2023 , Edited by admin on Fri Dec 15 15:45:44 UTC 2023
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CHEMBL2110725
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TT-79
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100000092200
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194468-36-5
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SUB28421
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16220212
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90241
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DTXSID80870081
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33MG53C7XW
Created by
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m11456
Created by
admin on Fri Dec 15 15:45:44 UTC 2023 , Edited by admin on Fri Dec 15 15:45:44 UTC 2023
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PRIMARY | Merck Index | ||
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DBSALT002672
Created by
admin on Fri Dec 15 15:45:44 UTC 2023 , Edited by admin on Fri Dec 15 15:45:44 UTC 2023
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C76266
Created by
admin on Fri Dec 15 15:45:44 UTC 2023 , Edited by admin on Fri Dec 15 15:45:44 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 |