(3S,4R,5R,7S)-6-oxapentacyclo[9.8.0.02,8.05,7.013,18]nonadeca-1(19),2(8),9,11,13,15,17-heptaene-3,4-diol
-
![(3S,4R,5R,7S)-6-oxapentacyclo[9.8.0.02,8.05,7.013,18]nonadeca-1(19),2(8),9,11,13,15,17-heptaene-3,4-diol structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/36c96406497947cba5b39bed9d27efa3.png "(3S,4R,5R,7S)-6-oxapentacyclo[9.8.0.02,8.05,7.013,18]nonadeca-1(19),2(8),9,11,13,15,17-heptaene-3,4-diol")
(3S,4R,5R,7S)-6-oxapentacyclo[9.8.0.02,8.05,7.013,18]nonadeca-1(19),2(8),9,11,13,15,17-heptaene-3,4-diol
structure -
-
CAS No:
76094-80-9
-
Formula:
C18H14O3
-
Chemical Name:
(3S,4R,5R,7S)-6-oxapentacyclo[9.8.0.02,8.05,7.013,18]nonadeca-1(19),2(8),9,11,13,15,17-heptaene-3,4-diol
-
Synonyms:
NIOSH/CW4640050;76094-80-9;Benzo(6,7)phenanthro(1,2-b)oxirene-10,11-diol, 1a,10,11,11a-tetrahydro-, (1aalpha,10alpha,11beta,11aalpha)-;CW46400500;1,2,3,4-Tetrahydro-3beta,4beta-epoxybenz[a]anthracene-1alpha,2beta-diol;(+-)-trans-3-beta,4-beta-Epoxy-1,2,3,4-tetrahydrobenz(a)anthracene-1-alpha,2-beta-diol;(+-)-1-alpha,2-beta-Dihydroxy-3-beta,4-beta-epoxy-1,2,3,4-tetrahydrobenz(a)anthracene trans-;Benz(a)anthracene, 1,2,3,4-tetrahydro-1-beta,2-alpha-dihydroxy-3-alpha,4-alpha-epoxy-, (E)-;Benz(a)anthracene-1-alpha,2-beta-diol, 1,2,3,4-tetrahydro-3-beta,4-beta-epoxy-, (+-)-(E)-
-
CAS No:
(3S,4R,5R,7S)-6-oxapentacyclo[9.8.0.02,8.05,7.013,18]nonadeca-1(19),2(8),9,11,13,15,17-heptaene-3,4-diol Basic Attributes
278.3 g/mol
278.094294304 g/mol
Computed Properties
Molecular Weight:278.3
XLogP3:2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Exact Mass:278.094294304
Monoisotopic Mass:278.094294304
Topological Polar Surface Area:53
Heavy Atom Count:21
Complexity:425
Defined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Request for Quotation