HMDB0037069 RDKit 3D Acoragermacrone 40 40 0 0 0 0 0 0 0 0999 V2000 -2.3766 -3.0926 -0.6407 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3753 -2.1475 -0.0398 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1079 -2.1559 -0.4097 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9484 -1.3060 0.0834 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9626 -1.9055 0.6086 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0083 0.1626 0.0565 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4253 0.6602 0.3979 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8227 0.1881 1.7848 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4253 0.0681 -0.5908 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6761 0.7498 -1.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7782 1.1525 -1.4022 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2835 1.7941 -0.1779 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7828 3.1587 0.1514 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1537 1.2409 0.6518 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6752 -0.1026 0.3684 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8849 -1.2246 0.9918 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8914 -3.6887 0.1405 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8421 -3.8218 -1.2834 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1266 -2.5365 -1.2544 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1300 -2.9187 -1.1775 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3709 0.6810 0.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4169 1.7518 0.3134 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5915 -0.6295 1.7294 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9542 -0.1410 2.3866 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3291 1.0121 2.3621 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7672 0.8365 -1.3221 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9245 -0.7346 -1.1712 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3422 -0.2856 -0.0759 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9383 0.0640 -2.1121 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2635 1.6785 -1.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3386 0.3036 -1.7805 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8573 1.9420 -2.2119 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3075 3.2539 -0.0523 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2752 3.8530 -0.5874 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0668 3.4948 1.1522 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4725 1.8094 1.5514 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9260 -0.2917 -0.7041 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6995 -0.1287 0.8599 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5580 -1.8768 1.6398 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1328 -0.8673 1.7112 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 2 0 4 6 1 0 6 7 1 0 7 8 1 0 7 9 1 0 6 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 12 14 2 0 14 15 1 0 15 16 1 0 16 2 1 0 1 17 1 0 1 18 1 0 1 19 1 0 3 20 1 0 6 21 1 0 7 22 1 0 8 23 1 0 8 24 1 0 8 25 1 0 9 26 1 0 9 27 1 0 9 28 1 0 10 29 1 0 10 30 1 0 11 31 1 0 11 32 1 0 13 33 1 0 13 34 1 0 13 35 1 0 14 36 1 0 15 37 1 0 15 38 1 0 16 39 1 0 16 40 1 0 M END