176405 -OEChem-10051722433D 89 89 0 0 0 0 0 0 0999 V2000 1.3062 1.6234 -1.0959 P 0 0 0 0 0 0 0 0 0 0 0 0 3.1059 -0.8922 -0.2525 P 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 2.6322 0.1676 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1900 1.6518 -1.7147 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7858 -0.2642 1.0747 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7144 -2.3934 0.2086 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3917 1.9699 -2.0750 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9460 -0.8017 -1.4935 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9662 -0.3623 0.4278 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4646 -0.0613 -0.3688 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6688 -0.2046 0.9521 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8317 -0.2462 0.8112 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5488 -2.8258 0.3314 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7303 2.1746 0.7676 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8707 -1.5075 0.5124 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9579 0.8977 0.7225 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5695 0.9368 0.8516 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4824 -1.4684 0.6415 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6084 -0.3245 0.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5900 -3.2003 1.4367 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3343 -2.8756 -1.0149 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5158 -3.9939 0.3187 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7846 3.3993 0.9636 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7522 2.1746 1.9459 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5694 2.4955 -0.5128 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3802 3.0370 0.8688 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4301 1.0454 -2.9722 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1901 -0.3440 1.2409 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2538 -3.3046 -0.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9900 3.4845 2.2692 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0727 4.1463 0.0917 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0759 1.9625 -4.0753 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9168 0.7562 -3.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6350 0.7027 2.2509 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5631 -1.7513 1.6816 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4460 -3.8698 -1.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4404 -4.3986 -0.0983 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9702 -0.6866 -1.1196 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9509 0.5913 1.6487 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9747 -1.1228 1.4684 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0128 1.8493 1.0108 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8526 -2.3457 0.6175 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9552 -4.2246 1.2887 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1057 -3.1718 2.4211 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4803 -2.5777 1.5163 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6851 -3.8971 -1.2104 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2164 -2.2408 -1.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6708 -2.6058 -1.8466 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0261 -4.9550 0.1733 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8043 -3.9080 -0.5114 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9723 -4.0797 1.2672 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3675 4.3287 1.0011 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2365 3.3536 1.9124 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0784 3.5172 0.1327 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2548 1.9232 2.8903 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5755 1.4687 1.8069 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2064 3.1653 2.0687 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3442 1.7490 -0.7086 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9215 2.5334 -1.3944 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0712 3.4664 -0.4265 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0585 2.1849 0.9533 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1079 0.0931 -3.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6803 -0.1208 0.2869 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5985 -2.7836 -1.4786 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3519 -1.2369 0.3937 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4846 2.6744 2.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8662 3.7912 2.8483 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2841 4.3213 2.2288 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4645 3.7913 -0.8639 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9141 4.5567 0.6593 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3740 4.9593 -0.1342 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 2.0069 -4.1074 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2572 1.6133 -5.0584 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2835 2.9869 -3.9291 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4993 1.6809 -3.0557 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2615 0.1083 -2.3021 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1376 0.2646 -4.0654 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3596 1.7058 1.9081 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7178 0.6734 2.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1367 0.5523 3.2149 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3149 -2.4823 0.9059 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6347 -1.8309 1.8892 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0080 -2.0408 2.5804 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9473 -3.1128 -2.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 -4.6734 -2.2056 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1949 -4.2687 -0.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6477 -3.9716 0.5196 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9928 -5.0736 -0.8338 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0709 -4.9888 0.5763 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 1 4 1 0 0 0 0 1 7 2 0 0 0 0 1 10 1 0 0 0 0 2 5 1 0 0 0 0 2 6 1 0 0 0 0 2 8 2 0 0 0 0 2 10 1 0 0 0 0 3 26 1 0 0 0 0 4 27 1 0 0 0 0 5 28 1 0 0 0 0 6 29 1 0 0 0 0 9 19 1 0 0 0 0 9 65 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 17 2 0 0 0 0 12 18 1 0 0 0 0 13 15 1 0 0 0 0 13 20 1 0 0 0 0 13 21 1 0 0 0 0 13 22 1 0 0 0 0 14 16 1 0 0 0 0 14 23 1 0 0 0 0 14 24 1 0 0 0 0 14 25 1 0 0 0 0 15 18 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 19 2 0 0 0 0 17 41 1 0 0 0 0 18 42 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 22 49 1 0 0 0 0 22 50 1 0 0 0 0 22 51 1 0 0 0 0 23 52 1 0 0 0 0 23 53 1 0 0 0 0 23 54 1 0 0 0 0 24 55 1 0 0 0 0 24 56 1 0 0 0 0 24 57 1 0 0 0 0 25 58 1 0 0 0 0 25 59 1 0 0 0 0 25 60 1 0 0 0 0 26 30 1 0 0 0 0 26 31 1 0 0 0 0 26 61 1 0 0 0 0 27 32 1 0 0 0 0 27 33 1 0 0 0 0 27 62 1 0 0 0 0 28 34 1 0 0 0 0 28 35 1 0 0 0 0 28 63 1 0 0 0 0 29 36 1 0 0 0 0 29 37 1 0 0 0 0 29 64 1 0 0 0 0 30 66 1 0 0 0 0 30 67 1 0 0 0 0 30 68 1 0 0 0 0 31 69 1 0 0 0 0 31 70 1 0 0 0 0 31 71 1 0 0 0 0 32 72 1 0 0 0 0 32 73 1 0 0 0 0 32 74 1 0 0 0 0 33 75 1 0 0 0 0 33 76 1 0 0 0 0 33 77 1 0 0 0 0 34 78 1 0 0 0 0 34 79 1 0 0 0 0 34 80 1 0 0 0 0 35 81 1 0 0 0 0 35 82 1 0 0 0 0 35 83 1 0 0 0 0 36 84 1 0 0 0 0 36 85 1 0 0 0 0 36 86 1 0 0 0 0 37 87 1 0 0 0 0 37 88 1 0 0 0 0 37 89 1 0 0 0 0 M END > DB12276 > drugbank > PUBCHEM > https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/inchikey/YLJOVCWVJCDPLN-UHFFFAOYSA-N/SDF?record_type=3d > CC(C)OP(=O)(OC(C)C)C(CC1=CC(=C(O)C(=C1)C(C)(C)C)C(C)(C)C)P(=O)(OC(C)C)OC(C)C > InChI=1S/C28H52O7P2/c1-18(2)32-36(30,33-19(3)4)25(37(31,34-20(5)6)35-21(7)8)17-22-15-23(27(9,10)11)26(29)24(16-22)28(12,13)14/h15-16,18-21,25,29H,17H2,1-14H3 > YLJOVCWVJCDPLN-UHFFFAOYSA-N > C28H52O7P2 > 562.665 > 562.31882801 > 3 > 89 > 61.56380951991849 > 0 > 1 > 0 > 0 > bis(propan-2-yl) {1-[bis(propan-2-yloxy)phosphoryl]-2-(3,5-di-tert-butyl-4-hydroxyphenyl)ethyl}phosphonate > 5.53 > 7.709088029333335 > -4.37 > 0 > 1 > 0 > 10.752964748761187 > -5.081820369039282 > 91.29 > 151.22650000000004 > 14 > 0 > 2.40e-02 g/l > diisopropyl 2-(3,5-di-tert-butyl-4-hydroxyphenyl)-1-(diisopropoxyphosphoryl)ethylphosphonate > 0 $$$$