BPA
7S,8R,9R-TRIHYDROXY-7,8,9,10-TETRAHYDRO BENZO[A]PYRENE
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as a non-polymer is covalently linked to polymer or other heterogen groups 1 entries
Chemical Component Summary | |
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Name | 7S,8R,9R-TRIHYDROXY-7,8,9,10-TETRAHYDRO BENZO[A]PYRENE |
Identifiers | (7S,8S,9R)-7,8,9,10-tetrahydrobenzo[a]pyrene-7,8,9-triol |
Formula | C20 H16 O3 |
Molecular Weight | 304.339 |
Type | NON-POLYMER |
Isomeric SMILES | c1cc2ccc3cc4c(c5c3c2c(c1)cc5)C[C@H]([C@@H]([C@H]4O)O)O |
InChI | InChI=1S/C20H16O3/c21-16-9-14-13-7-6-11-3-1-2-10-4-5-12(18(13)17(10)11)8-15(14)19(22)20(16)23/h1-8,16,19-23H,9H2/t16-,19+,20+/m1/s1 |
InChIKey | GFANZDFKCCJYRF-UXPWSPDFSA-N |
Chemical Details | |
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Formal Charge | 0 |
Atom Count | 39 |
Chiral Atom Count | 3 |
Bond Count | 43 |
Aromatic Bond Count | 19 |
Related Resource References
Resource Name | Reference |
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PubChem | 5326598 |