27 28 0 0000 0 0 0 0 0999 V2000 6.4373 5.5523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 6.4373 4.1523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 7.6497 3.4523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 8.8622 4.1523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 8.8622 5.5523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 7.6497 6.2523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 10.0746 6.2523 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 11.2870 5.5523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 11.2870 4.1523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 12.4995 3.4523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 13.7119 4.1523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 13.7119 5.5523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 12.4995 6.2523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 14.9244 3.4523 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 16.1368 4.1523 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 16.1368 5.5523 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 5.2249 3.4523 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 4.0124 4.1523 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 4.0124 5.5523 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 2.8000 3.4523 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 1.4000 3.4523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 17.3492 3.4523 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 16.4991 2.8000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 3.6501 2.8000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 3.6501 1.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 16.4991 1.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 18.7492 3.4523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 1 1 0 5 7 1 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 8 1 0 11 14 1 0 14 15 1 0 15 16 2 0 2 17 1 0 17 18 1 0 18 19 2 0 18 20 1 0 20 21 1 0 15 22 1 0 15 23 1 0 18 24 1 0 24 25 1 0 23 26 1 0 22 27 1 0 M END > InChI=1S/C16H20O6P2S3/c1-17-23(25,18-2)21-13-5-9-15(10-6-13)27-16-11-7-14(8-12-16)22-24(26,19-3)20-4/h5-12H,1-4H3/i1D3,2D3,3D3,4D3 > WWJZWCUNLNYYAU-MGKWXGLJSA-N > 1/0/N:21,25,26,27,1,3,10,12,6,4,9,13,2,11,5,8,20,24,23,22,17,14,18,15,19,16,7/E:(1,2,3,4)(5,6,7,8)(9,10,11,12)(13,14)(15,16)(17,18,19,20)(21,22)(23,24)(25,26)/I:/E:m/rA:39nCCCCCCSCCCCCCOPSOPSOCOOOCCCH.i2H.i2H.i2H.i2H.i2H.i2H.i2H.i2H.i2H.i2H.i2H.i2/rB:d1;s2;d3;s4;s1d5;s5;s7;d8;s9;d10;s11;s8d12;s11;s14;d15;s2;s17;d18;s18;s20;s15;s15;s18;s24;s23;s22;s21;s21;s21;s25;s25;s25;s26;s26;s26;s27;s27;s27;/rC:6.4373,5.5523,0;6.4373,4.1523,0;7.6497,3.4523,0;8.8622,4.1523,0;8.8622,5.5523,0;7.6497,6.2523,0;10.0746,6.2523,0;11.287,5.5523,0;11.287,4.1523,0;12.4995,3.4523,0;13.7119,4.1523,0;13.7119,5.5523,0;12.4995,6.2523,0;14.9244,3.4523,0;16.1368,4.1523,0;16.1368,5.5523,0;5.2249,3.4523,0;4.0124,4.1523,0;4.0124,5.5523,0;2.8,3.4523,0;1.4,3.4523,0;17.3492,3.4523,0;16.4991,2.8,0;3.6501,2.8,0;3.6501,1.4,0;16.4991,1.4,0;18.7492,3.4523,0;.4101,4.4422,0;.1876,2.7523,0;0,3.4523,0;2.9501,.1876,0;4.3501,.1876,0;3.6501,0,0;15.7991,.1876,0;17.1991,.1876,0;16.4991,0,0;19.9617,4.1523,0;19.9617,2.7523,0;20.1492,3.4523,0; > C16 H20 O6 P2 S3 > 478.5429 > C1C=C(SC2C=CC(OP(OC([2H])([2H])[2H])(OC([2H])([2H])[2H])=S)=CC=2)C=CC=1OP(OC([2H])([2H])[2H])(OC([2H])([2H])[2H])=S > 24532171 $$$$