HMDB0034214 RDKit 3D 5-Deoxykievitone 45 47 0 0 0 0 0 0 0 0999 V2000 5.4299 1.2291 0.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0572 -0.1191 0.7216 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0968 -1.1429 1.1032 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7961 -0.4625 0.8294 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7302 0.5177 0.4607 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7783 -0.0489 -0.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0815 -0.1856 -1.8614 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2967 0.2053 -2.3684 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1490 -0.7288 -2.7295 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1121 -1.1482 -2.2815 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4176 -1.0166 -0.9723 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5185 -0.4691 -0.0936 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0827 -0.3875 1.2157 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2660 0.0520 1.4397 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2863 -0.8426 0.7284 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5534 -0.1048 0.5966 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7201 1.0629 1.3262 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8712 1.8323 1.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9333 1.4540 0.5069 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1099 2.1861 0.4340 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7943 0.3015 -0.2238 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6248 -0.4737 -0.1856 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5509 -1.6141 -0.9370 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7181 -1.4700 -0.4355 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2611 -2.4091 -1.0487 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5356 1.3729 0.3911 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9302 2.0268 0.8502 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1830 1.3474 -0.8194 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8139 -2.0696 0.5406 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0671 -0.7440 0.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9774 -1.3094 2.1893 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5280 -1.4599 1.1861 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1883 0.7560 1.4078 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1609 1.4504 0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5816 0.1208 -3.3197 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3389 -0.8582 -3.7861 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8167 -1.5672 -2.9782 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3393 1.0853 1.0213 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4574 0.1023 2.5092 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4392 -1.6831 1.4988 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9046 1.3856 1.9823 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9767 2.7403 1.8702 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2355 2.9341 -0.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5982 -0.0335 -0.8517 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3351 -1.8833 -1.5097 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 2 3 4 5 1 0 5 6 1 0 6 7 2 0 7 8 1 0 7 9 1 0 9 10 2 0 10 11 1 0 11 12 2 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 2 0 17 18 1 0 18 19 2 0 19 20 1 0 19 21 1 0 21 22 2 0 22 23 1 0 15 24 1 0 24 25 2 0 12 6 1 0 22 16 1 0 24 11 1 0 1 26 1 0 1 27 1 0 1 28 1 0 3 29 1 0 3 30 1 0 3 31 1 0 4 32 1 0 5 33 1 0 5 34 1 0 8 35 1 0 9 36 1 0 10 37 1 0 14 38 1 0 14 39 1 0 15 40 1 0 17 41 1 0 18 42 1 0 20 43 1 0 21 44 1 0 23 45 1 0 M END