Marvin 02081315242D 26 30 0 0 0 0 999 V2000 13.5404 -2.0937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7871 -1.7483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7819 -2.5749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2236 2.3892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2224 1.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9407 1.1544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9389 2.8017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6494 2.3928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6487 1.5691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0792 2.3904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3644 2.8018 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0784 1.5667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3609 1.1540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5383 0.3472 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6935 1.0089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3544 0.2645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9931 0.4124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5137 1.0876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5014 2.8054 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9393 0.3302 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6526 -0.0805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6563 -0.3280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8328 -0.4076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4850 -1.1538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9651 -1.8254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1362 -1.0030 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8 7 2 0 0 0 0 13 14 1 0 0 0 0 14 16 1 0 0 0 0 15 12 1 0 0 0 0 7 4 1 0 0 0 0 8 9 1 0 0 0 0 15 16 2 0 0 0 0 16 23 1 0 0 0 0 2 1 1 0 0 0 0 22 17 1 0 0 0 0 4 5 2 0 0 0 0 17 18 2 0 0 0 0 18 15 1 0 0 0 0 3 2 1 0 0 0 0 4 19 1 0 0 0 0 5 6 1 0 0 0 0 6 20 1 0 0 0 0 8 11 1 0 0 0 0 20 21 1 0 0 0 0 22 23 2 0 0 0 0 9 13 1 0 0 0 0 12 10 1 0 0 0 0 10 11 1 0 0 0 0 12 13 2 0 0 0 0 6 9 2 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 25 2 1 0 0 0 0 2 26 1 0 0 0 0 M END > CHEBI:65977 > glycyrrhizol B > An organic heteropentacyclic compound that is 2H-pyrano[3',4',5'',6'']-pterocarpene substituted by a hydroxy group at position 7, a methoxy group at position 5 and geminal methyl groups at position 2''. Isolated from the roots of Glycyrrhiza uralensis, it exhibits antibacterial activity. > 3 > 7-hydroxy-5-methoxy-2'',2''-dimethyl-2H-pyrano[3',4',5'',6'']-pterocarpene > 12-methoxy-3,3-dimethyl-3H,7H-furo[3,2-c:5,4-f']dichromen-10-ol > C21H18O5 > 350.36460 > 350.11542 > 0 > COc1cc(O)cc2OCc3c(oc4c5C=CC(C)(C)Oc5ccc34)-c12 > InChI=1S/C21H18O5/c1-21(2)7-6-13-15(26-21)5-4-12-14-10-24-17-9-11(22)8-16(23-3)18(17)20(14)25-19(12)13/h4-9,22H,10H2,1-3H3 > BKLGAGSBCOUJGV-UHFFFAOYSA-N > 18589783 > 16441081 $$$$