LMPR0106050022 LIPID_MAPS_STRUCTURE_DATABASE 41 44 0 0 0 0 0 0 0 0999 V2000 7.7068 -7.2479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7982 -7.7726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7982 -8.8221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5245 -9.3467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4331 -8.8221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6156 -7.7726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5245 -6.1986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4331 -5.6739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3399 -7.5722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9568 -6.7232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5245 -7.2479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4331 -7.7726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3419 -7.2479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3419 -6.1986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1575 -4.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2487 -4.3002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9753 -4.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3399 -4.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0662 -4.3002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3399 -5.8744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0171 -5.5556 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7068 -9.3467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6156 -8.8221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5899 -9.4594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0323 -9.9106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1991 -9.8544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6156 -6.7232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6508 -8.1944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4312 -4.3002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3419 -5.1492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8840 -4.3002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9753 -5.8744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0661 -3.2706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9064 -9.3369 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4312 -3.2706 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5394 -4.8150 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1966 -8.7350 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4910 -8.3488 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0147 -8.8221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1230 -9.3369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0147 -7.7924 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13 14 1 0 0 0 0 14 20 1 0 0 0 0 14 8 1 0 0 0 0 13 12 1 0 0 0 0 13 9 1 0 0 0 0 11 7 1 0 0 0 0 11 6 1 0 0 0 0 12 11 2 0 0 0 0 12 5 1 0 0 0 0 6 23 1 0 0 0 0 6 1 1 0 0 0 0 10 20 1 0 0 0 0 7 8 1 0 0 0 0 10 9 1 0 0 0 0 4 5 1 0 0 0 0 23 22 1 0 0 0 0 23 4 1 0 0 0 0 2 1 1 0 0 0 0 3 22 1 0 0 0 0 3 2 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 16 18 1 0 0 0 0 18 20 1 0 0 0 0 17 19 1 0 0 0 0 20 21 1 6 0 0 0 23 24 1 6 0 0 0 6 27 1 1 0 0 0 14 30 1 1 0 0 0 18 29 1 6 0 0 0 17 32 1 0 0 0 0 31 17 1 0 0 0 0 22 26 1 0 0 0 0 22 25 1 0 0 0 0 13 28 1 6 0 0 0 19 33 2 0 0 0 3 34 1 1 0 0 29 35 2 0 0 0 29 36 1 0 0 0 28 37 1 0 0 0 28 38 2 0 0 0 34 39 1 0 0 0 39 40 1 0 0 0 39 41 2 0 0 0 M END > LMPR0106050022 > 14R-carboxyl eburicoic acid acetate > 3beta-acetoxy-24-methylene-8-lanostene-14,21-dioic acid > C33H50O6 > 542.36 > Prenol Lipids [PR] > Isoprenoids [PR01] > C30 isoprenoids (triterpenes) [PR0106] > Lanostane triterpenoids [PR010605] > > VYHORNFNNCJMIA-SWQXDQEHSA-N > InChI=1S/C33H50O6/c1-19(2)20(3)9-10-22(28(35)36)23-14-18-33(29(37)38)25-11-12-26-30(5,6)27(39-21(4)34)15-16-31(26,7)24(25)13-17-32(23,33)8/h19,22-23,26-27H,3,9-18H2,1-2,4-8H3,(H,35,36)(H,37,38)/t22-,23-,26+,27+,31-,32-,33+/m1/s1 > C1C[C@H](OC(=O)C)C(C)(C)[C@]2([H])CCC3=C([C@]21C)CC[C@]1(C)[C@@]([H])([C@H](C(O)=O)CCC(=C)C(C)C)CC[C@]13C(=O)O > - > - > - > - > - > - > 178334399 > - > - > - > - > - > 81056 > 41106788 $$$$