Mrv1652309092222292D 34 39 0 0 1 0 999 V2000 -0.1528 -1.1700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1473 -0.4015 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.3982 0.2730 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.1843 0.7313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7023 1.2377 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1101 1.9869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9401 2.0705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4217 1.3954 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.7600 2.1479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2775 2.8171 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0872 0.6413 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5730 -0.0255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3934 0.0619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7279 0.8160 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5483 0.9034 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2138 0.1492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0341 0.2366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8545 0.3240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1890 1.0781 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.0094 1.1655 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7032 1.7449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4442 2.1075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4747 2.5376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8828 1.6575 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.3970 2.3243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5766 2.2369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2421 1.4828 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2410 2.3078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2564 0.5515 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.9934 -0.2769 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.5280 -0.9053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0981 1.6474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2040 2.4656 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7491 1.0642 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 6 0 0 0 2 3 1 0 0 0 0 3 4 1 6 0 0 0 5 4 1 6 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 6 0 0 0 9 10 1 0 0 0 0 8 11 1 0 0 0 0 11 12 1 6 0 0 0 12 13 1 0 0 0 0 14 13 1 1 0 0 0 14 15 1 0 0 0 0 15 16 1 1 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 6 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 15 24 1 0 0 0 0 24 25 1 1 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 14 27 1 0 0 0 0 8 27 1 0 0 0 0 27 28 1 1 0 0 0 11 29 1 0 0 0 0 29 5 1 6 0 0 0 29 30 1 0 0 0 0 2 30 1 0 0 0 0 30 31 1 6 0 0 0 5 32 1 0 0 0 0 32 33 2 0 0 0 0 32 34 1 0 0 0 0 3 34 1 0 0 0 0 M END > NP0290019 > NP-MRD > C[C@@H]1[C@@H]2C[C@@]3(CC[C@]4(CO)[C@H](CC[C@@H]5[C@@]6(C)CC[C@@H](O)C(C)(C)[C@@H]6CC[C@@]45C)[C@@H]3[C@@H]1C)C(=O)O2 > InChI=1S/C30H48O4/c1-17-18(2)24-19-7-8-22-27(5)11-10-23(32)26(3,4)21(27)9-12-28(22,6)30(19,16-31)14-13-29(24)15-20(17)34-25(29)33/h17-24,31-32H,7-16H2,1-6H3/t17-,18+,19+,20-,21-,22+,23+,24-,27-,28+,29+,30-/m0/s1 > OGQSJGVYDRJSSU-ASPVCRLKSA-N > C30H48O4 > 472.71 > 472.355260026 > 3 > 82 > 55.34039983944112 > 1 > 2 > 0 > 0 > (1R,4S,5R,8R,10R,13R,14R,17R,18S,19S,20S,21S)-10-hydroxy-4-(hydroxymethyl)-5,9,9,13,19,20-hexamethyl-22-oxahexacyclo[19.2.1.0^{1,18}.0^{4,17}.0^{5,14}.0^{8,13}]tetracosan-23-one > 5.062320062000001 > 0 > 6 > 0 > 19.66096410642018 > 19.4894333901713 > -0.4949597865073948 > 66.76 > 132.723 > 1 > 0 > (1R,4S,5R,8R,10R,13R,14R,17R,18S,19S,20S,21S)-10-hydroxy-4-(hydroxymethyl)-5,9,9,13,19,20-hexamethyl-22-oxahexacyclo[19.2.1.0^{1,18}.0^{4,17}.0^{5,14}.0^{8,13}]tetracosan-23-one > 0 > NP0290019 > (1r,4s,5r,8r,10r,13r,14r,17r,18s,19s,20s,21s)-10-hydroxy-4-(hydroxymethyl)-5,9,9,13,19,20-hexamethyl-22-oxahexacyclo[19.2.1.0¹,¹⁸.0⁴,¹⁷.0⁵,¹⁴.0⁸,¹³]tetracosan-23-one $$$$