Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C18H14O8.C10H14N2O2 |
Molecular Weight | 552.5293 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 3 / 3 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
N[C@@H](COC(N)=O)CC1=CC=CC=C1.OC(=O)[C@@H](OC(=O)C2=CC=CC=C2)[C@H](OC(=O)C3=CC=CC=C3)C(O)=O
InChI
InChIKey=GYMBZHFIXLUVKP-WYELKWRUSA-N
InChI=1S/C18H14O8.C10H14N2O2/c19-15(20)13(25-17(23)11-7-3-1-4-8-11)14(16(21)22)26-18(24)12-9-5-2-6-10-12;11-9(7-14-10(12)13)6-8-4-2-1-3-5-8/h1-10,13-14H,(H,19,20)(H,21,22);1-5,9H,6-7,11H2,(H2,12,13)/t13-,14-;9-/m01/s1
Molecular Formula | C18H14O8 |
Molecular Weight | 358.299 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Molecular Formula | C10H14N2O2 |
Molecular Weight | 194.2304 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 20:02:03 GMT 2023
by
admin
on
Sat Dec 16 20:02:03 GMT 2023
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Record UNII |
Q8W4YW23VS
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Record Status |
Validated (UNII)
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Record Version |
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-
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164991754
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Q8W4YW23VS
Created by
admin on Sat Dec 16 20:02:03 GMT 2023 , Edited by admin on Sat Dec 16 20:02:03 GMT 2023
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2411304-02-2
Created by
admin on Sat Dec 16 20:02:03 GMT 2023 , Edited by admin on Sat Dec 16 20:02:03 GMT 2023
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PRIMARY |