(7S,8S,9S)-7,8,9,10-tetrahydrobenzo[a]pyrene-7,8,9-triol
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![(7S,8S,9S)-7,8,9,10-tetrahydrobenzo[a]pyrene-7,8,9-triol structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/eab4dc47c5f24a4b8d98feb15ea607f7.png "(7S,8S,9S)-7,8,9,10-tetrahydrobenzo[a]pyrene-7,8,9-triol")
(7S,8S,9S)-7,8,9,10-tetrahydrobenzo[a]pyrene-7,8,9-triol
structure -
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CAS No:
61176-59-8
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Formula:
C20H16O3
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Chemical Name:
(7S,8S,9S)-7,8,9,10-tetrahydrobenzo[a]pyrene-7,8,9-triol
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Synonyms:
7,8,9,10-Tetrahydro-7alpha,8beta,9beta-trihydroxy-benzo(a)pyrene;BENZO(a)PYRENE- 7,8,9-TRIOL,7,8,9,10-TETRAHYDRO-, (7-alpha,8-beta,9-beta)-;61176-59-8;(7alpha,8beta,9beta)-7,8,9,10-tetrahydro benzo(a)pyrene-7,8,9-triol;(7-alpha,8-beta,9-beta)-Benzo(a)pyrene- 7,8,9-triol,7,8,9,10-tetrahydro-;DTXSID00210066;7,8,9,10-Tetrahydro benzo(a)pyrene-7,8,9-triol, (7alpha,8beta,9beta)-;Q27266345;UNII-756KTM5WWE component GFANZDFKCCJYRF-VDGAXYAQSA-N;7,8,9,10-Tetrahydrobenzo[a]pyrene-7alpha,8beta,9beta-triol
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CAS No:
(7S,8S,9S)-7,8,9,10-tetrahydrobenzo[a]pyrene-7,8,9-triol Basic Attributes
304.3 g/mol
304.109944368 g/mol
DTXSID00210066
Computed Properties
Molecular Weight:304.3
XLogP3:3
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:3
Exact Mass:304.109944368
Monoisotopic Mass:304.109944368
Topological Polar Surface Area:60.7
Heavy Atom Count:23
Complexity:466
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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