CCRIS 2085

(5R,6R,7S)-19-methyl-4-oxapentacyclo[9.8.0.02,8.03,5.012,17]nonadeca-1(11),2(8),9,12,14,16,18-heptaene-6,7-diol

Also Known As: KST-1A0117|anti-5-Methylchrysene-1,2-diol-3,4-epoxide|(7s,8r,8ar)-10-methyl-7,8,8a,9a-tetrahydrochryseno[3,4-b]oxirene-7,8-diol|1,2-Dihydroxy-epoxy-1,2,3,4-tetrahydro-5-methylchrysene|trans-1,2-Dihydroxy-syn-3,4-epoxy-1,2,3,4-tetrahydro-5-methylchrysene|anti-(+-)-trans-1,2,3,4-Tetrahydro-5-methylchrysene-1,2-diol-3,4-epoxide|Chryseno(3,4-b)oxirene-1,2-diol, 1,2,2a,3a-tetrahydro-4-methyl-, (1R,2S,2aS,3aR)-rel-|(1alpha,2beta,2aalpha,3aalpha)-1,2,2a,3a-Tetrahydro-4-methylchryseno(3,4-b)oxirene-1,2-diol|Chryseno(3,4-b)oxirene-1,2-diol, 1,2,2a,3a-tetrahydro-4-methyl-, (1-alpha,2-beta,2a-alpha,3a-alpha)-

Molecular Formula	C19H16O3
Molecular Weight	292.10995 g/mol
LogP	3.15
Topological Polar Surface Area	52.99 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	3
Rotatable Bonds	0
Exact Mass	292.10995
Heavy Atoms	22
Complexity	930.8

Chemical Identifiers

CAS Number	5334-12-3
SMILES	CC1=CC2=CC=CC=C2C3=C1C4=C(C=C3)[C@@H]([C@H]([C@@H]5C4O5)O)O