Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C23H16O6.2C11H16N2O2 |
Molecular Weight | 804.8834 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 4 / 4 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CC[C@H]1[C@@H](CC2=CN=CN2C)COC1=O.CC[C@H]3[C@@H](CC4=CN=CN4C)COC3=O.OC(=O)C5=CC6=C(C=CC=C6)C(CC7=C8C=CC=CC8=CC(C(O)=O)=C7O)=C5O
InChI
InChIKey=ZCECPEINCZVBPT-IWXKTIJTSA-N
InChI=1S/C23H16O6.2C11H16N2O2/c24-20-16(14-7-3-1-5-12(14)9-18(20)22(26)27)11-17-15-8-4-2-6-13(15)10-19(21(17)25)23(28)29;2*1-3-10-8(6-15-11(10)14)4-9-5-12-7-13(9)2/h1-10,24-25H,11H2,(H,26,27)(H,28,29);2*5,7-8,10H,3-4,6H2,1-2H3/t;2*8-,10-/m.00/s1
Molecular Formula | C11H16N2O2 |
Molecular Weight | 208.2569 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Molecular Formula | C23H16O6 |
Molecular Weight | 388.3695 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 15:06:36 GMT 2023
by
admin
on
Fri Dec 15 15:06:36 GMT 2023
|
Record UNII |
9O3667EIIX
|
Record Status |
Validated (UNII)
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Record Version |
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-
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DTXSID20212320
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63036-94-2
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9O3667EIIX
Created by
admin on Fri Dec 15 15:06:36 GMT 2023 , Edited by admin on Fri Dec 15 15:06:36 GMT 2023
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