Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C46H58N4O9 |
Molecular Weight | 810.9741 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 9 / 9 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[H][C@@]12N3CC[C@@]14C5=CC(=C(OC)C=C5N(C)[C@@]4([H])[C@](O)([C@H](OC(C)=O)[C@]2(CC)C=CC3)C(=O)OC)[C@]6(C[C@@]7([H])CN(C[C@@](O)(CC)C7)CCC8=C6NC9=CC=CC=C89)C(=O)OC
InChI
InChIKey=JXLYSJRDGCGARV-KSNABSRWSA-N
InChI=1S/C46H58N4O9/c1-8-42(54)23-28-24-45(40(52)57-6,36-30(15-19-49(25-28)26-42)29-13-10-11-14-33(29)47-36)32-21-31-34(22-35(32)56-5)48(4)38-44(31)17-20-50-18-12-16-43(9-2,37(44)50)39(59-27(3)51)46(38,55)41(53)58-7/h10-14,16,21-22,28,37-39,47,54-55H,8-9,15,17-20,23-26H2,1-7H3/t28-,37-,38+,39+,42+,43+,44+,45-,46-/m0/s1
Molecular Formula | C46H58N4O9 |
Molecular Weight | 810.9741 |
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 16:44:51 UTC 2023
by
admin
on
Fri Dec 15 16:44:51 UTC 2023
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Record UNII |
3D8VFG675W
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Record Status |
Validated (UNII)
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Record Version |
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-
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Official Name | English | ||
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Common Name | English | ||
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Systematic Name | English | ||
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Common Name | English | ||
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Common Name | English | ||
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Common Name | English |
Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C274
Created by
admin on Fri Dec 15 16:44:51 UTC 2023 , Edited by admin on Fri Dec 15 16:44:51 UTC 2023
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NCI_THESAURUS |
C932
Created by
admin on Fri Dec 15 16:44:51 UTC 2023 , Edited by admin on Fri Dec 15 16:44:51 UTC 2023
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Code System | Code | Type | Description | ||
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68543
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100000079135
Created by
admin on Fri Dec 15 16:44:51 UTC 2023 , Edited by admin on Fri Dec 15 16:44:51 UTC 2023
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3D8VFG675W
Created by
admin on Fri Dec 15 16:44:51 UTC 2023 , Edited by admin on Fri Dec 15 16:44:51 UTC 2023
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C152888
Created by
admin on Fri Dec 15 16:44:51 UTC 2023 , Edited by admin on Fri Dec 15 16:44:51 UTC 2023
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CHEMBL2110750
Created by
admin on Fri Dec 15 16:44:51 UTC 2023 , Edited by admin on Fri Dec 15 16:44:51 UTC 2023
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1438
Created by
admin on Fri Dec 15 16:44:51 UTC 2023 , Edited by admin on Fri Dec 15 16:44:51 UTC 2023
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DTXSID101018043
Created by
admin on Fri Dec 15 16:44:51 UTC 2023 , Edited by admin on Fri Dec 15 16:44:51 UTC 2023
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15228-71-4
Created by
admin on Fri Dec 15 16:44:51 UTC 2023 , Edited by admin on Fri Dec 15 16:44:51 UTC 2023
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SUB00072MIG
Created by
admin on Fri Dec 15 16:44:51 UTC 2023 , Edited by admin on Fri Dec 15 16:44:51 UTC 2023
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PRIMARY |
Related Record | Type | Details | ||
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SALT/SOLVATE -> PARENT |
Related Record | Type | Details | ||
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ACTIVE MOIETY |