Mrv0541 01201411432D 36 40 0 0 0 0 999 V2000 -3.1644 -3.0016 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.1644 -3.8282 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.4510 -4.2374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4510 -2.5842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7376 -3.0016 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.7365 -3.8282 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.0242 -4.2383 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3082 -3.8264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0263 -2.5851 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.3113 -2.9982 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.3125 -1.3497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0300 -1.7617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4024 -1.7627 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.3964 -2.5838 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.1005 -2.9973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8152 -2.5943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1089 -1.3594 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8216 -1.7748 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.4370 -1.2254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1046 -0.4703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2839 -0.5533 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.4513 -5.0640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1728 -4.6465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7409 -4.6507 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7451 -2.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0312 -3.4108 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3173 -2.1709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3882 -3.4066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3966 -0.9351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1021 -2.1834 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5341 -2.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7333 0.0632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9919 0.8483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0759 -0.1053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8815 -2.5904 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8797 -4.2426 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16 18 1 0 0 0 0 17 18 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 10 1 0 0 0 0 9 10 1 0 0 0 0 3 6 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 17 1 0 0 0 0 5 4 1 0 0 0 0 3 22 1 0 0 0 0 5 6 1 0 0 0 0 3 23 1 0 0 0 0 6 24 1 6 0 0 0 9 12 1 0 0 0 0 5 25 1 1 0 0 0 10 14 1 0 0 0 0 9 26 1 6 0 0 0 13 11 1 0 0 0 0 10 27 1 1 0 0 0 11 12 1 0 0 0 0 14 28 1 6 0 0 0 13 14 1 0 0 0 0 13 29 1 1 0 0 0 1 2 1 0 0 0 0 17 30 1 6 0 0 0 1 4 1 0 0 0 0 18 31 1 1 0 0 0 2 3 1 0 0 0 0 21 32 1 6 0 0 0 5 9 1 0 0 0 0 32 33 1 0 0 0 0 13 17 1 0 0 0 0 32 34 2 0 0 0 0 14 15 1 0 0 0 0 1 35 1 6 0 0 0 15 16 1 0 0 0 0 2 36 1 1 0 0 0 M END > CHEBI:67954 > 2alpha,3beta-dihydroxylup-20(29)-ene > A pentacyclic triterpenoid that is lup-20(29)-ene substituted by hydroxy groups at positions 2 and 3 (the 2α,3β stereoisomer). It has been isolated from Juglans sinensis. > 3 > 2alpha,3bbeta-lup-20(29)-ene-2,3-diol > C30H50O2 > 442.71680 > 442.38108 > 0 > CC(=C)[C@@H]1CC[C@]2(C)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12 > InChI=1S/C30H50O2/c1-18(2)19-11-13-27(5)15-16-29(7)20(24(19)27)9-10-23-28(6)17-21(31)25(32)26(3,4)22(28)12-14-30(23,29)8/h19-25,31-32H,1,9-17H2,2-8H3/t19-,20+,21+,22-,23+,24+,25-,27+,28-,29+,30+/m0/s1 > OESLKRXCBRUCJZ-BUXXFNAFSA-N > 21309591 $$$$