Details
Stereochemistry | ACHIRAL |
Molecular Formula | C23H27NO.C6H8O7 |
Molecular Weight | 525.5901 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 3 / 3 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)CC(O)(CC(O)=O)C(O)=O.CN1[C@H]2CC[C@@H]1C[C@@H](C2)OC3C4=C(CCC5=C3C=CC=C5)C=CC=C4
InChI
InChIKey=CHQGYMXXKZPWOI-BWSPSPBFSA-N
InChI=1S/C23H27NO.C6H8O7/c1-24-18-12-13-19(24)15-20(14-18)25-23-21-8-4-2-6-16(21)10-11-17-7-3-5-9-22(17)23;7-3(8)1-6(13,5(11)12)2-4(9)10/h2-9,18-20,23H,10-15H2,1H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/t18-,19+,20+;
Molecular Formula | C6H8O7 |
Molecular Weight | 192.1235 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C23H27NO |
Molecular Weight | 333.4666 |
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
Fri Dec 15 16:50:43 UTC 2023
by
admin
on
Fri Dec 15 16:50:43 UTC 2023
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Record UNII |
05LW13XKKR
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Record Status |
Validated (UNII)
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Record Version |
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DTXSID4045557
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2169-75-7
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28143-97-7
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NON-SPECIFIC STOICHIOMETRY | |||
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m4183
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05LW13XKKR
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169431
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SUB01588MIG
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218-516-1
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100000087732
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CHEMBL1946186
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50190
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admin on Fri Dec 15 16:50:43 UTC 2023 , Edited by admin on Fri Dec 15 16:50:43 UTC 2023
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Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE | |||
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PARENT -> SALT/SOLVATE |
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ACTIVE MOIETY |