Mrv1652309062222122D 38 42 0 0 1 0 999 V2000 1.8467 -2.5217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4097 -1.8220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5852 -1.8506 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7972 -1.0936 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3602 -0.3939 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5401 -0.4840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0417 0.1009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8211 -0.1694 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 0.9205 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7527 1.3575 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1709 1.9425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1935 2.0549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5307 1.0829 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.0705 1.7068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8807 1.5512 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4205 2.1751 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1502 2.9545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3400 3.1101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6900 3.5784 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1510 0.7718 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6909 1.3956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9612 0.6162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6190 1.1142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2959 0.6425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0564 -0.1470 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5544 -0.8048 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.3793 -0.7885 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6496 -1.5679 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9919 -2.0659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0081 -2.8908 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3150 -1.5943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2316 -0.1633 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5819 -0.9102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6918 -0.7871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8816 -0.6316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6112 0.1479 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8010 0.3035 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1289 -0.4536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 5 4 1 1 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 13 14 1 6 0 0 0 14 15 1 0 0 0 0 15 16 1 1 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 2 0 0 0 0 15 20 1 0 0 0 0 20 21 1 6 0 0 0 20 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 25 26 1 1 0 0 0 26 27 1 1 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 26 31 1 0 0 0 0 25 32 1 0 0 0 0 22 32 1 0 0 0 0 32 33 1 1 0 0 0 32 34 1 0 0 0 0 34 35 1 0 0 0 0 36 35 1 6 0 0 0 20 36 1 0 0 0 0 36 37 1 0 0 0 0 5 37 1 0 0 0 0 13 37 1 0 0 0 0 37 38 1 6 0 0 0 M END > NP0237145 > NP-MRD > CC(=O)O[C@@H]1C[C@@H]2[C@@](C)([C@H]3CC[C@@]4(C)[C@@H](CC=C4[C@]13C)[C@H]1COC(=O)C1)[C@H](CC(=O)OC2(C)C)OC(C)=O > InChI=1S/C30H42O8/c1-16(31)36-23-13-22-27(3,4)38-26(34)14-24(37-17(2)32)30(22,7)21-10-11-28(5)19(18-12-25(33)35-15-18)8-9-20(28)29(21,23)6/h9,18-19,21-24H,8,10-15H2,1-7H3/t18-,19+,21+,22+,23-,24+,28+,29+,30-/m1/s1 > HJPHEKIKOJMFTJ-QCEFSOIBSA-N > C30H42O8 > 530.658 > 530.287968312 > 4 > 80 > 56.84852417653394 > 1 > 0 > 0 > 0 > (1R,2R,3S,8R,10R,11R,15S,16S)-3-(acetyloxy)-2,7,7,11,16-pentamethyl-5-oxo-15-[(3S)-5-oxooxolan-3-yl]-6-oxatetracyclo[9.7.0.0^{2,8}.0^{12,16}]octadec-12-en-10-yl acetate > 2.8873522746666667 > 0 > 5 > 0 > -6.428350674604788 > 105.20000000000002 > 137.15949999999998 > 5 > 0 > (1R,2R,3S,8R,10R,11R,15S,16S)-3-(acetyloxy)-2,7,7,11,16-pentamethyl-5-oxo-15-[(3S)-5-oxooxolan-3-yl]-6-oxatetracyclo[9.7.0.0^{2,8}.0^{12,16}]octadec-12-en-10-yl acetate > 0 > NP0237145 > (1r,2r,3s,8r,10r,11r,15s,16s)-3-(acetyloxy)-2,7,7,11,16-pentamethyl-5-oxo-15-[(3s)-5-oxooxolan-3-yl]-6-oxatetracyclo[9.7.0.0²,⁸.0¹²,¹⁶]octadec-12-en-10-yl acetate $$$$