+++поиск по Reaxys

[petrovps]

Доброе время суток, коллеги!

Очень интересует информация по бетулину

C=C(C)C4CCC5(CO)CCC3(C)C(CCC2C1(C)CCC(O)C(C)(C)C1CCC23C)C45 JME 2006.05 Thu Jan 19 14:24:35 MSK 2012 32 36 0 0 0 0 0 0 0 0999 V2000 8.4175 9.2758 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2867 7.6821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3405 0.0105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4686 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5754 4.5459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3059 2.4476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0390 4.5464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3417 5.2780 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 1.0029 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0125 4.8383 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1863 3.1464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1443 7.4621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0360 5.9464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8236 5.2464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8236 1.0464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3987 3.8464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7137 6.1832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0360 1.7464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6733 3.8464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4609 3.1464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6131 8.1300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1863 1.7464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7520 7.3158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2485 5.2464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6111 1.7464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8236 3.8464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4609 5.9464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3987 1.0464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6111 3.1464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6733 5.2464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2485 3.8464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0360 3.1464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 21 2 0 0 0 0 2 21 1 0 0 0 0 3 28 1 0 0 0 0 4 28 1 0 0 0 0 5 29 1 0 0 0 0 6 31 1 0 0 0 0 7 32 1 0 0 0 0 8 10 1 0 0 0 0 9 22 1 0 0 0 0 10 30 1 0 0 0 0 11 16 1 0 0 0 0 11 22 1 0 0 0 0 12 17 1 0 0 0 0 12 23 1 0 0 0 0 13 14 1 0 0 0 0 13 24 1 0 0 0 0 14 26 1 0 0 0 0 15 18 1 0 0 0 0 15 25 1 0 0 0 0 16 29 1 0 0 0 0 17 30 1 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 19 30 1 0 0 0 0 20 31 1 0 0 0 0 21 23 1 0 0 0 0 22 28 1 0 0 0 0 23 27 1 0 0 0 0 24 27 1 0 0 0 0 24 31 1 0 0 0 0 25 28 1 0 0 0 0 25 29 1 0 0 0 0 26 29 1 0 0 0 0 26 32 1 0 0 0 0 27 30 1 0 0 0 0 31 32 1 0 0 0 0 M END

и бетулоновой кислоте

C=C(C)C4CCC5(C(=O)O)CCC3(C)C(CCC2C1(C)CCC(=O)C(C)(C)C1CCC23C)C45 JME 2006.05 Thu Jan 19 14:28:13 MSK 2012 33 37 0 0 0 0 0 0 0 0999 V2000 8.4625 9.6011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1829 8.2730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2308 0.4389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1529 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2927 4.6100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8193 2.5125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6433 4.6121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7293 5.7063 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 0.6569 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8497 3.4916 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7909 3.2121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6406 6.0121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7489 7.5278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4282 5.3121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4282 1.1121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0033 3.9121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6406 1.8121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3183 6.2489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0655 3.2121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2779 3.9121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5587 8.5319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6064 4.8703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7909 1.8121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3565 7.3815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8530 5.3121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2157 1.8121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4282 3.9121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0655 6.0121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0033 1.1121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2157 3.2121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8530 3.9121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6406 3.2121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2779 5.3121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 21 2 0 0 0 0 2 21 1 0 0 0 0 3 29 1 0 0 0 0 4 29 1 0 0 0 0 5 30 1 0 0 0 0 6 31 1 0 0 0 0 7 32 1 0 0 0 0 8 22 2 0 0 0 0 9 23 2 0 0 0 0 10 22 1 0 0 0 0 11 16 1 0 0 0 0 11 23 1 0 0 0 0 12 14 1 0 0 0 0 12 25 1 0 0 0 0 13 18 1 0 0 0 0 13 24 1 0 0 0 0 14 27 1 0 0 0 0 15 17 1 0 0 0 0 15 26 1 0 0 0 0 16 30 1 0 0 0 0 17 32 1 0 0 0 0 18 33 1 0 0 0 0 19 20 1 0 0 0 0 19 31 1 0 0 0 0 20 33 1 0 0 0 0 21 24 1 0 0 0 0 22 33 1 0 0 0 0 23 29 1 0 0 0 0 24 28 1 0 0 0 0 25 28 1 0 0 0 0 25 31 1 0 0 0 0 26 29 1 0 0 0 0 26 30 1 0 0 0 0 27 30 1 0 0 0 0 27 32 1 0 0 0 0 28 33 1 0 0 0 0 31 32 1 0 0 0 0 M END

Спасибо!!!!

[Serty]

По моему вы третий, кто интересуется бетулиновой кислотой. Надо не стирать файлы, может еще пригодятся

[petrovps]

Спасибо огромное, Serty!!!