Marvin 06281111432D 34 38 0 0 1 0 999 V2000 10.3673 -9.4547 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.3673 -8.6297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6799 -9.8397 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.2774 -9.8397 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.9648 -9.4547 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.2774 -10.6647 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.0824 -8.2172 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.5623 -11.0772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6799 -8.2172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7698 -8.6297 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.6799 -10.6647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9648 -8.6297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0824 -9.8397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5623 -9.4547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9648 -11.0772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0824 -7.3922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8473 -10.6647 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.7698 -9.4547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7698 -7.0072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4849 -8.2172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8473 -9.8397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4849 -7.3922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4224 -10.1972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6799 -9.1247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2774 -9.0147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8098 -11.8747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1773 -11.8197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1324 -11.1047 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7698 -7.8872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0548 -8.9322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2774 -11.4897 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9648 -10.2522 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3514 -6.2962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1764 -6.2894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 3 1 1 0 0 0 0 13 1 1 0 0 0 0 1 23 1 6 0 0 0 7 2 1 0 0 0 0 9 2 2 0 0 0 0 5 3 1 0 0 0 0 11 3 1 0 0 0 0 3 24 1 1 0 0 0 5 4 1 0 0 0 0 14 4 1 0 0 0 0 4 25 1 1 0 0 0 6 4 1 0 0 0 0 12 5 1 0 0 0 0 5 32 1 6 0 0 0 15 6 1 0 0 0 0 8 6 1 0 0 0 0 6 31 1 6 0 0 0 16 7 1 0 0 0 0 7 30 1 1 0 0 0 10 7 1 0 0 0 0 17 8 1 0 0 0 0 26 8 1 0 0 0 0 27 8 1 0 0 0 0 12 9 1 0 0 0 0 18 10 1 0 0 0 0 20 10 1 0 0 0 0 10 29 1 1 0 0 0 15 11 1 0 0 0 0 18 13 1 0 0 0 0 21 14 1 0 0 0 0 19 16 1 0 0 0 0 17 28 1 1 0 0 0 21 17 1 0 0 0 0 22 19 1 0 0 0 0 22 20 1 0 0 0 0 33 19 1 0 0 0 0 34 19 1 0 0 0 0 M END > CHEBI:10352 > beta-amyrin > A pentacyclic triterpenoid that is oleanane substituted at the 3β-position by a hydroxy group and containing a double bond between positions 12 and 13. It is one of the most commonly occurring triterpenoids in higher plants. > 3 > Beta-amyrin; beta-Amyrin; beta-Amyrenol; amyrin; 3beta-hydroxyolean-12-ene; (3beta)-olean-12-en-3-ol > olean-12-en-3beta-ol > C30H50O > 426.71740 > 426.38617 > 0 > [H][C@@]12CC(C)(C)CC[C@]1(C)CC[C@]1(C)C2=CC[C@]2([H])[C@@]3(C)CC[C@H](O)C(C)(C)[C@]3([H])CC[C@@]12C > InChI=1S/C30H50O/c1-25(2)15-16-27(5)17-18-29(7)20(21(27)19-25)9-10-23-28(6)13-12-24(31)26(3,4)22(28)11-14-30(23,29)8/h9,21-24,31H,10-19H2,1-8H3/t21-,22-,23+,24-,27+,28-,29+,30+/m0/s1 > JFSHUTJDVKUMTJ-QHPUVITPSA-N > 559-70-6 > 2063468 > 559-70-6 > C08616 > C00003738 > LMPR0106150015 > CPD-6948 > 16478469; 17803686; 21046981; 24079177; 24960408; 25026352; 25115087; 5639923; 6875511 $$$$