Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C20H13NO4 |
| Molecular Weight | 331.3215 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O[C@H]1C=CC2=CC3=C4C(C=CC5=C4C(C=C3)=C(C=C5)[N+]([O-])=O)=C2[C@@H]1O
InChI
InChIKey=DDTKLIBTCCSFGT-OXJNMPFZSA-N
InChI=1S/C20H13NO4/c22-16-8-4-12-9-11-2-5-13-15(21(24)25)7-3-10-1-6-14(18(11)17(10)13)19(12)20(16)23/h1-9,16,20,22-23H/t16-,20+/m0/s1
Approval Year
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Preferred Name | English | ||
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| Code System | Code | Type | Description | ||
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DTXSID80913422
Created by
admin on Mon Mar 31 22:14:47 GMT 2025 , Edited by admin on Mon Mar 31 22:14:47 GMT 2025
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A82Z59WPM4
Created by
admin on Mon Mar 31 22:14:47 GMT 2025 , Edited by admin on Mon Mar 31 22:14:47 GMT 2025
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98151-91-8
Created by
admin on Mon Mar 31 22:14:47 GMT 2025 , Edited by admin on Mon Mar 31 22:14:47 GMT 2025
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PRIMARY | |||
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119566
Created by
admin on Mon Mar 31 22:14:47 GMT 2025 , Edited by admin on Mon Mar 31 22:14:47 GMT 2025
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PRIMARY |
SUBSTANCE RECORD
![Structure of 9,10-Dihydro-3-nitrobenzo[a]pyrene-9,10-diol, (9R,10R)-rel-](/img/7da19138-9b9e-4ab1-b592-904cee720f03.svg "Structure of 9,10-Dihydro-3-nitrobenzo[a]pyrene-9,10-diol, (9R,10R)-rel-")