Mrv1652309082220272D 47 48 0 0 1 0 999 V2000 18.9714 8.2765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7245 7.4893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9193 7.3095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6724 6.5223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8672 6.3426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6203 5.5554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8152 5.3756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5683 4.5884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7631 4.4086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5162 3.6214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7110 3.4416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4642 2.6544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6590 2.4747 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.1007 3.0821 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4121 1.6875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.9038 1.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4258 0.3527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6386 0.5995 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.9761 0.1078 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.2191 0.4356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5566 -0.0561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6513 -0.8756 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7995 0.2717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1371 -0.2200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3800 0.1078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7176 -0.3839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9605 -0.0561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2981 -0.5478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5410 -0.2200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8786 -0.7117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1215 -0.3839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4591 -0.8756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5537 -1.6952 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7020 -0.5478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0396 -1.0396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2825 -0.7117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4277 -1.1315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0464 -0.5858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8516 -0.7656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7186 0.1713 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1027 0.0934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6484 0.7121 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0708 -0.7117 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8278 -1.0396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4903 -0.5478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9225 -1.8591 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6301 1.4245 0.0000 O 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 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 1 0 0 0 15 13 1 1 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 6 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 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 1 0 0 0 0 32 34 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 36 37 2 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 38 40 1 0 0 0 0 40 41 1 0 0 0 0 36 41 1 0 0 0 0 41 42 2 0 0 0 0 19 43 1 6 0 0 0 43 44 1 0 0 0 0 44 45 1 0 0 0 0 44 46 2 0 0 0 0 18 47 1 0 0 0 0 15 47 1 0 0 0 0 M END > NP0271987 > NP-MRD > CCCCCCCCCCCC[C@H](O)[C@H]1CC[C@@H](O1)[C@@H](CC(O)CCCCCCCCCC(O)CCC1=CC(C)OC1=O)OC(C)=O > InChI=1S/C39H70O8/c1-4-5-6-7-8-9-10-14-17-20-23-35(43)36-26-27-37(47-36)38(46-31(3)40)29-34(42)22-19-16-13-11-12-15-18-21-33(41)25-24-32-28-30(2)45-39(32)44/h28,30,33-38,41-43H,4-27,29H2,1-3H3/t30?,33?,34?,35-,36+,37+,38+/m0/s1 > BIODFBOSASJNMO-ATEGIRMUSA-N > C39H70O8 > 666.981 > 666.507069214 > 6 > 117 > 84.12221425529069 > 0 > 3 > 0 > 0 > (1R)-3,13-dihydroxy-1-[(2R,5R)-5-[(1S)-1-hydroxytridecyl]oxolan-2-yl]-15-(5-methyl-2-oxo-2,5-dihydrofuran-3-yl)pentadecyl acetate > 8.963723372333332 > 0 > 2 > 0 > 14.229716824163997 > 13.388717288752478 > -1.2127987838880707 > 122.52000000000002 > 187.6531 > 30 > 0 > (1R)-3,13-dihydroxy-1-[(2R,5R)-5-[(1S)-1-hydroxytridecyl]oxolan-2-yl]-15-(5-methyl-2-oxo-5H-furan-3-yl)pentadecyl acetate > 0 > NP0271987 > (1r)-3,13-dihydroxy-1-[(2r,5r)-5-[(1s)-1-hydroxytridecyl]oxolan-2-yl]-15-(5-methyl-2-oxo-5h-furan-3-yl)pentadecyl acetate $$$$