Mrv1652309062201532D 37 41 0 0 1 0 999 V2000 -2.0470 2.8379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2400 2.6664 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9851 1.8818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1781 1.7103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0768 0.9256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8838 0.7541 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1387 -0.0305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9233 -0.2854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6378 0.1271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3523 -0.2854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0668 0.1271 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3523 -1.1104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6378 -1.5229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6378 -2.3479 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9233 -1.1104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1387 -1.3654 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8838 -2.1500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0768 -2.3215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1781 -3.1062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3739 -3.7192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1190 -4.5039 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1809 -3.5477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4358 -2.7631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2428 -2.5916 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6538 -0.6979 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.1712 -0.6979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5837 -1.4124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4087 -1.4124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8212 -2.1269 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8212 -0.6979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4087 0.0165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8212 0.7310 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5837 0.0165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4752 0.3126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2822 0.4841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5371 1.2687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3441 1.4402 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 2 0 0 0 0 8 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 1 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 2 0 0 0 0 17 23 1 0 0 0 0 23 24 1 0 0 0 0 16 25 1 0 0 0 0 7 25 1 0 0 0 0 25 26 1 6 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 30 2 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 33 2 0 0 0 0 26 33 1 0 0 0 0 5 34 2 0 0 0 0 34 35 1 0 0 0 0 35 36 2 0 0 0 0 3 36 1 0 0 0 0 36 37 1 0 0 0 0 M END > NP0222134 > NP-MRD > COC1=CC(\C=C2/[C@H]([C@@H](C3=C(O)C=C(O)C=C23)C2=CC=C(O)C=C2O)C2=CC(O)=CC(O)=C2)=CC=C1O > InChI=1S/C29H24O8/c1-37-26-7-14(2-5-23(26)34)6-21-22-11-19(33)13-25(36)28(22)29(20-4-3-16(30)12-24(20)35)27(21)15-8-17(31)10-18(32)9-15/h2-13,27,29-36H,1H3/b21-6-/t27-,29+/m1/s1 > HUGYHAODBSIAEC-VBPTVYELSA-N > C29H24O8 > 500.503 > 500.147117733 > 8 > 61 > 51.13856413530294 > 0 > 7 > 0 > 0 > (1E,2R,3R)-3-(2,4-dihydroxyphenyl)-2-(3,5-dihydroxyphenyl)-1-[(4-hydroxy-3-methoxyphenyl)methylidene]-2,3-dihydro-1H-indene-4,6-diol > 5.221194563666666 > 0 > 5 > 0 > 8.752614190941792 > 8.290834648080338 > -4.893926602953779 > 150.84 > 138.6505 > 4 > 0 > (1E,2R,3R)-3-(2,4-dihydroxyphenyl)-2-(3,5-dihydroxyphenyl)-1-[(4-hydroxy-3-methoxyphenyl)methylidene]-2,3-dihydroindene-4,6-diol > 0 > NP0222134 > (1e,2r,3r)-3-(2,4-dihydroxyphenyl)-2-(3,5-dihydroxyphenyl)-1-[(4-hydroxy-3-methoxyphenyl)methylidene]-2,3-dihydroindene-4,6-diol $$$$