| SpectraBase Spectrum ID |
1cyHbmEe4u |
| Name |
7.beta.,8.alpha.-dihydroxy-9.beta.,10.beta.-dimethylmethylenedioxy-7,8,9,10-tet-rahydrobenzo[a]pyrene |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C23H20O4 |
| InChI |
InChI=1S/C23H20O4/c1-23(2)26-21-18-14-9-8-12-5-3-4-11-6-7-13(17(14)16(11)12)10-15(18)19(24)20(25)22(21)27-23/h3-10,19-22,24-25H,1-2H3/t19-,20+,21+,22-/m0/s1 |
| InChIKey |
KTDOLPKHYVBXHG-CBPXPLCBSA-N |
| Molecular Weight |
360.409 g/mol |
| SMILES |
O[C@]1([C@]2([C@@](c3c4c5c6c(ccc5cc3[C@@]1(O)[H])cccc6cc4)(OC(O2)(C)C)[H])[H])[H] |
| SPLASH |
splash10-0lyx-6291000000-c4a64f9ea561cf6eeb7d |
| Source of Spectrum |
C-99-5127-3 |
| Synonyms |
(7S,8R,8aS,11aR)-10,10-dimethyl-7,8,8a,11a-tetrahydrobenzo[10,11]chryseno[3,4-d][1,3]dioxole-7,8-diol |
| Wiley ID |
1348614 |
![7.beta.,8.alpha.-dihydroxy-9.beta.,10.beta.-dimethylmethylenedioxy-7,8,9,10-tet-rahydrobenzo[a]pyrene](/api/spectrum/1cyHbmEe4u/structure.png?h=300&w=458 "7.beta.,8.alpha.-dihydroxy-9.beta.,10.beta.-dimethylmethylenedioxy-7,8,9,10-tet-rahydrobenzo[a]pyrene")
