Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C27H34N2O7.ClH |
Molecular Weight | 535.029 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 3 / 3 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.CCOC(=O)[C@H](CCC1=CC=CC=C1)N[C@@H](C)C(=O)N2CC3=C(C[C@H]2C(O)=O)C=C(OC)C(OC)=C3
InChI
InChIKey=JXRAXHBVZQZSIC-JKVLGAQCSA-N
InChI=1S/C27H34N2O7.ClH/c1-5-36-27(33)21(12-11-18-9-7-6-8-10-18)28-17(2)25(30)29-16-20-15-24(35-4)23(34-3)14-19(20)13-22(29)26(31)32;/h6-10,14-15,17,21-22,28H,5,11-13,16H2,1-4H3,(H,31,32);1H/t17-,21-,22-;/m0./s1
Molecular Formula | ClH |
Molecular Weight | 36.461 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C27H34N2O7 |
Molecular Weight | 498.5681 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 3 / 3 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 07:44:11 UTC 2023
by
admin
on
Sat Dec 16 07:44:11 UTC 2023
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Record UNII |
Q1UMG3UH45
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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 |
C247
Created by
admin on Sat Dec 16 07:44:11 UTC 2023 , Edited by admin on Sat Dec 16 07:44:11 UTC 2023
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Code System | Code | Type | Description | ||
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DBSALT000504
Created by
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54889
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CHEMBL1165
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admin on Sat Dec 16 07:44:11 UTC 2023 , Edited by admin on Sat Dec 16 07:44:11 UTC 2023
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SUB03312MIG
Created by
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1445426
Created by
admin on Sat Dec 16 07:44:11 UTC 2023 , Edited by admin on Sat Dec 16 07:44:11 UTC 2023
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C29267
Created by
admin on Sat Dec 16 07:44:11 UTC 2023 , Edited by admin on Sat Dec 16 07:44:11 UTC 2023
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m7585
Created by
admin on Sat Dec 16 07:44:11 UTC 2023 , Edited by admin on Sat Dec 16 07:44:11 UTC 2023
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PRIMARY | Merck Index | ||
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Q1UMG3UH45
Created by
admin on Sat Dec 16 07:44:11 UTC 2023 , Edited by admin on Sat Dec 16 07:44:11 UTC 2023
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236066
Created by
admin on Sat Dec 16 07:44:11 UTC 2023 , Edited by admin on Sat Dec 16 07:44:11 UTC 2023
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100000091389
Created by
admin on Sat Dec 16 07:44:11 UTC 2023 , Edited by admin on Sat Dec 16 07:44:11 UTC 2023
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Q1UMG3UH45
Created by
admin on Sat Dec 16 07:44:11 UTC 2023 , Edited by admin on Sat Dec 16 07:44:11 UTC 2023
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DTXSID7044267
Created by
admin on Sat Dec 16 07:44:11 UTC 2023 , Edited by admin on Sat Dec 16 07:44:11 UTC 2023
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82586-52-5
Created by
admin on Sat Dec 16 07:44:11 UTC 2023 , Edited by admin on Sat Dec 16 07:44:11 UTC 2023
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PRIMARY |
Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE |
Related Record | Type | Details | ||
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IMPURITY -> PARENT |
Related Record | Type | Details | ||
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ACTIVE MOIETY |