Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C21H26N2O3.C4H6O6 |
Molecular Weight | 504.5296 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 7 / 7 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
O[C@H]([C@@H](O)C(O)=O)C(O)=O.[H][C@@]12CC[C@H](O)[C@@H](C(=O)OC)[C@@]1([H])C[C@]3([H])N(CCC4=C3NC5=C4C=CC=C5)C2
InChI
InChIKey=HMEXTTWSBUBIOL-URXSSEHMSA-N
InChI=1S/C21H26N2O3.C4H6O6/c1-26-21(25)19-15-10-17-20-14(13-4-2-3-5-16(13)22-20)8-9-23(17)11-12(15)6-7-18(19)24;5-1(3(7)8)2(6)4(9)10/h2-5,12,15,17-19,22,24H,6-11H2,1H3;1-2,5-6H,(H,7,8)(H,9,10)/t12-,15-,17-,18-,19-;1-,2-/m01/s1
Molecular Formula | C21H26N2O3 |
Molecular Weight | 354.4427 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 5 / 5 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
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 |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 15:16:35 UTC 2023
by
admin
on
Fri Dec 15 15:16:35 UTC 2023
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Record UNII |
7359P0A2QF
|
Record Status |
Validated (UNII)
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Record Version |
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-
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274278
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24721101
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92634-48-5
Created by
admin on Fri Dec 15 15:16:35 UTC 2023 , Edited by admin on Fri Dec 15 15:16:35 UTC 2023
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NON-SPECIFIC STOICHIOMETRY | |||
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63989-78-6
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DTXSID90981713
Created by
admin on Fri Dec 15 15:16:35 UTC 2023 , Edited by admin on Fri Dec 15 15:16:35 UTC 2023
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7359P0A2QF
Created by
admin on Fri Dec 15 15:16:35 UTC 2023 , Edited by admin on Fri Dec 15 15:16:35 UTC 2023
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PRIMARY |
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ACTIVE MOIETY |