Ketcher 01232014392D 1 1.00000 0.00000 0 36 36 0 1 0 999 V2000 12.9460 -34.2575 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6306 -33.1354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3327 -33.5728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3408 -33.1259 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6253 -34.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9328 -33.8507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3445 -33.8999 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0164 -33.4848 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.5287 -34.0157 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.1565 -33.4185 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.9088 -32.8116 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.9377 -32.6801 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0600 -33.5850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3861 -33.9740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7121 -33.5850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7338 -33.9740 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0383 -33.9740 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4078 -33.5850 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 11.2431 -34.4935 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4223 -32.6763 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8177 -34.7624 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0046 -34.8284 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.5986 -34.3911 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 17.5986 -35.2734 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.2745 -33.8467 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.3495 -34.4380 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.2087 -33.0678 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 18.1618 -32.1760 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.5040 -33.2743 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.0347 -33.6966 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4399 -33.9740 0.0000 R1 0 0 0 0 0 0 0 0 0 0 0 0 7.2391 -33.5126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2391 -32.5898 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2192 -34.7624 0.0000 R2 0 0 0 0 0 0 0 0 0 0 0 0 8.0184 -35.2239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0184 -36.1467 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 3 2 1 0 0 0 4 3 1 0 0 0 5 4 1 0 0 0 5 6 1 1 0 0 1 6 1 1 0 0 7 1 1 0 0 0 8 2 1 0 0 0 9 5 1 0 0 0 10 4 1 0 0 0 3 11 1 0 0 0 6 12 1 0 0 0 14 13 1 0 0 0 15 14 1 0 0 0 13 16 1 0 0 0 15 17 1 0 0 0 16 18 1 0 0 0 18 19 1 0 0 0 18 20 2 0 0 0 18 7 1 0 0 0 14 21 1 6 0 0 14 22 1 1 0 0 23 9 1 0 0 0 23 24 2 0 0 0 23 25 1 0 0 0 23 26 1 0 0 0 27 28 2 0 0 0 27 29 1 0 0 0 27 30 1 0 0 0 10 27 1 0 0 0 31 32 1 0 0 0 32 17 1 0 0 0 32 33 2 0 0 0 35 34 1 0 0 0 36 35 2 0 0 0 21 35 1 0 0 0 M END > CHEBI:16152 > 1-phosphatidyl-1D-myo-inositol 3,4-bisphosphate > 3 > CHEBI:11285; CHEBI:672 > PtsIns-3,4-P2; PtsIns(3,4)P2; 1-Phosphatidyl-1D-myo-inositol 3,4-bisphosphate; 1,2-Diacyl-sn-glycero-3-phospho-(1'-myo-inositol-3',4'-bisphosphate) > 1-O-(3-sn-phosphatidyl)-1D-myo-inositol 3,4-bis(dihydrogen phosphate) > C11H19O19P3R2 > 548.179 > 547.97334 > 0 > [C@@H]1(C(C(C([C@H](C1O)OP(=O)(O)O)OP(=O)(O)O)O)O)OP(OC[C@@](COC(*)=O)(OC(*)=O)[H])(O)=O > C11554 $$$$