Mrv0541 01291411392D 42 42 0 0 0 0 999 V2000 0.1372 0.6112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5772 1.0237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2917 0.6112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5771 1.8487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8517 1.0236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9950 0.6110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2805 1.0235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5661 0.6111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2806 1.8485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7095 1.0234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8528 0.6108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1383 1.0234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4239 0.6109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1384 1.8483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5673 1.0233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2828 1.0229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5684 0.6105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9973 0.6104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8540 1.0230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1395 0.6106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8540 1.8480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4251 1.0231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7106 0.6107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9962 1.0232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2817 0.6107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9962 1.8482 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0062 1.0238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7207 0.6113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4350 1.0238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1495 0.6114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4350 1.8488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9973 -0.2146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7118 1.0229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7117 -0.6271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2827 -0.6270 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.4262 0.6103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4261 -0.2147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7117 -1.4521 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.1407 1.0228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8551 0.6102 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 15.1407 1.8478 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9972 -1.8645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22 23 1 0 0 0 0 12 13 1 0 0 0 0 23 24 2 0 0 0 0 2 4 1 0 0 0 0 24 25 1 0 0 0 0 12 14 1 0 0 0 0 24 26 1 0 0 0 0 25 15 1 0 0 0 0 13 10 1 0 0 0 0 8 5 1 0 0 0 0 7 8 1 0 0 0 0 3 27 1 0 0 0 0 11 15 1 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 7 9 1 0 0 0 0 29 30 1 0 0 0 0 16 17 1 0 0 0 0 29 31 1 0 0 0 0 1 5 1 0 0 0 0 16 18 1 0 0 0 0 6 10 1 0 0 0 0 17 19 2 0 0 0 0 2 3 1 0 0 0 0 19 20 1 0 0 0 0 1 2 2 0 0 0 0 19 21 1 0 0 0 0 11 12 2 0 0 0 0 20 22 1 0 0 0 0 6 7 2 0 0 0 0 18 32 2 0 0 0 0 18 33 1 0 0 0 0 32 34 1 0 0 0 0 32 35 1 0 0 0 0 33 36 2 0 0 0 0 34 37 2 0 0 0 0 34 38 1 0 0 0 0 36 39 1 0 0 0 0 39 40 1 0 0 0 0 39 41 2 0 0 0 0 36 37 1 0 0 0 0 38 42 1 0 0 0 0 M CHG 1 40 -1 M END > CHEBI:57916 > 3-hexaprenyl-4-hydroxy-5-methoxybenzoate > A 3-methoxy-4-hydroxy-5-all-trans-polyprenylbenzoate in which the polyprenyl chain contains 6 prenyl units; major species at pH 7.3. > 3 > 3-methoxy-4-hydroxy-5-all-trans-hexaprenylbenzoate; 3-hexaprenyl-4-hydroxy-5-methoxybenzoate(1-); 3-hexaprenyl-4-hydroxy-5-methoxybenzoate anion > 3-[(2E,6E,10E,14E,18E)-3,7,11,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaen-1-yl]-4-hydroxy-5-methoxybenzoate > C38H55O4 > 575.84140 > 575.41058 > -1 > COc1cc(cc(C\C=C(/C)CC\C=C(/C)CC\C=C(/C)CC\C=C(/C)CC\C=C(/C)CCC=C(C)C)c1O)C([O-])=O > InChI=1S/C38H56O4/c1-28(2)14-9-15-29(3)16-10-17-30(4)18-11-19-31(5)20-12-21-32(6)22-13-23-33(7)24-25-34-26-35(38(40)41)27-36(42-8)37(34)39/h14,16,18,20,22,24,26-27,39H,9-13,15,17,19,21,23,25H2,1-8H3,(H,40,41)/p-1/b29-16+,30-18+,31-20+,32-22+,33-24+ > YSZSVGFMAJXGMQ-FRICUITQSA-M $$$$