HMDB0303768 RDKit 3D Casoxin D 30 29 0 0 0 0 0 0 0 0999 V2000 -1.9080 1.5172 -0.1026 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2003 0.0430 0.0518 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7381 -0.0599 0.0804 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6468 -0.7518 -0.8564 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8178 -1.7564 -0.6532 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3640 -2.6172 0.3249 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.9500 -2.5610 -1.8900 F 0 0 0 0 0 0 0 0 0 0 0 0 0.6390 -1.5690 -0.5598 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1180 -0.9859 -1.7536 F 0 0 0 0 0 0 0 0 0 0 0 0 1.1313 -2.9246 -0.8351 F 0 0 0 0 0 0 0 0 0 0 0 0 1.3673 -1.1979 0.6208 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0671 -2.2061 1.5858 F 0 0 0 0 0 0 0 0 0 0 0 0 2.7463 -1.6096 0.3691 F 0 0 0 0 0 0 0 0 0 0 0 0 1.4555 0.0411 1.3187 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3710 -0.2113 2.4082 F 0 0 0 0 0 0 0 0 0 0 0 0 0.3063 0.3274 2.0447 F 0 0 0 0 0 0 0 0 0 0 0 0 1.9531 1.2880 0.7356 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2562 1.7520 -0.3690 F 0 0 0 0 0 0 0 0 0 0 0 0 1.6593 2.2786 1.7086 F 0 0 0 0 0 0 0 0 0 0 0 0 3.4440 1.4178 0.5505 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7566 2.6697 -0.0102 F 0 0 0 0 0 0 0 0 0 0 0 0 4.1263 1.3903 1.7505 F 0 0 0 0 0 0 0 0 0 0 0 0 4.0088 0.4546 -0.2418 F 0 0 0 0 0 0 0 0 0 0 0 0 -2.8594 2.0914 -0.2017 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3899 1.9454 0.7787 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3335 1.6830 -1.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9108 -0.2464 1.0776 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0456 0.4819 0.9989 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0476 -1.1176 0.2157 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1943 0.4331 -0.7748 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 4 5 1 0 5 6 1 0 5 7 1 0 5 8 1 0 8 9 1 0 8 10 1 0 8 11 1 0 11 12 1 0 11 13 1 0 11 14 1 0 14 15 1 0 14 16 1 0 14 17 1 0 17 18 1 0 17 19 1 0 17 20 1 0 20 21 1 0 20 22 1 0 20 23 1 0 1 24 1 0 1 25 1 0 1 26 1 0 2 27 1 0 3 28 1 0 3 29 1 0 3 30 1 0 M END