Mrv1652309082220472D 57 63 0 0 0 0 999 V2000 10.7279 0.6912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6164 -0.1263 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8528 -0.4384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2721 0.1476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4471 0.1515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1350 0.9152 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8611 -0.4291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8572 -1.2541 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5698 -1.6700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2629 -1.8441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8489 -1.2634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5659 -2.4950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2785 -2.9108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9948 -2.5016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7074 -2.9174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7035 -3.7424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4161 -4.1582 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9872 -4.1516 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2746 -3.7358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8495 -2.9041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1370 -2.4883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4206 -2.8975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4168 -3.7225 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7004 -4.1316 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6965 -4.9566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1293 -4.1383 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8457 -3.7291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5582 -4.1449 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7081 -2.4816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9917 -2.8908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2791 -2.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5628 -2.8841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5589 -3.7091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8425 -4.1183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1300 -3.7025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4136 -4.1117 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1338 -2.8775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8502 -2.4683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2830 -1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9994 -1.2408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0032 -0.4158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2907 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2945 0.8250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5820 1.2408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5743 -0.4092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5704 -1.2342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8541 -1.6433 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7196 -0.0067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4321 -0.4225 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1485 -0.0133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1524 0.8117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4398 1.2275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4437 2.0525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1601 2.4617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1639 3.2866 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8726 2.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8688 1.2208 0.0000 C 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 5 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 3 11 1 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 13 19 1 0 0 0 0 12 20 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 23 26 1 0 0 0 0 26 27 2 0 0 0 0 20 27 1 0 0 0 0 27 28 1 0 0 0 0 22 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 32 33 2 0 0 0 0 33 34 1 0 0 0 0 34 35 2 0 0 0 0 35 36 1 0 0 0 0 35 37 1 0 0 0 0 37 38 2 0 0 0 0 32 38 1 0 0 0 0 31 39 1 0 0 0 0 39 40 2 0 0 0 0 40 41 1 0 0 0 0 41 42 2 0 0 0 0 42 43 1 0 0 0 0 43 44 1 0 0 0 0 42 45 1 0 0 0 0 45 46 2 0 0 0 0 39 46 1 0 0 0 0 46 47 1 0 0 0 0 41 48 1 0 0 0 0 48 49 1 0 0 0 0 49 50 1 0 0 0 0 7 50 1 0 0 0 0 50 51 1 0 0 0 0 51 52 2 0 0 0 0 52 53 1 0 0 0 0 53 54 2 0 0 0 0 54 55 1 0 0 0 0 54 56 1 0 0 0 0 56 57 2 0 0 0 0 51 57 1 0 0 0 0 M END > NP0272239 > NP-MRD > COC1=C2CCC(C3=CC=C(O)C=C3)\C3=C(/O)\C=C(/CCC(=C3)C(C3=CC=C(O)C=C3)C3=CC(CCC(C4=CC=C(O)C=C4)C(=C2)C(O)=C1)=C(OC)C=C3O)OC > InChI=1S/C48H48O9/c1-55-37-19-10-33-24-41(43(52)25-37)39(29-6-15-35(50)16-7-29)20-11-31-22-40(44(53)26-46(31)56-2)38(28-4-13-34(49)14-5-28)21-12-32-23-42(45(54)27-47(32)57-3)48(33)30-8-17-36(51)18-9-30/h4-9,13-18,22-27,38-39,48-54H,10-12,19-21H2,1-3H3/b33-24+,37-25+,43-41- > WPKKLCUANHCUBD-HGICLDMLSA-N > C48H48O9 > 768.903 > 768.329833126 > 9 > 105 > 83.13246681487439 > 0 > 6 > 0 > 0 > (1E,19Z,21E)-2,10,18-tris(4-hydroxyphenyl)-6,14,22-trimethoxytetracyclo[17.5.1.1^{3,7}.1^{11,15}]heptacosa-1(25),3(27),4,6,11(26),12,14,19,21-nonaene-4,12,20-triol > 9.055601238333335 > 1 > 7 > 0 > 9.11926582708474 > 8.61138911407119 > -4.496227548010335 > 149.07 > 225.64849999999993 > 6 > 0 > (1E,19Z,21E)-2,10,18-tris(4-hydroxyphenyl)-6,14,22-trimethoxytetracyclo[17.5.1.1^{3,7}.1^{11,15}]heptacosa-1(25),3(27),4,6,11(26),12,14,19,21-nonaene-4,12,20-triol > 0 > NP0272239 > (1e,19e,21e)-2,10,18-tris(4-hydroxyphenyl)-6,14,22-trimethoxytetracyclo[17.5.1.1³,⁷.1¹¹,¹⁵]heptacosa-1(25),3(27),4,6,11(26),12,14,19,21-nonaene-4,12,20-triol $$$$