LMPR0106050023 LIPID_MAPS_STRUCTURE_DATABASE 47 50 0 0 0 0 0 0 0 0999 V2000 8.9184 -9.5977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0163 -10.1187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0163 -11.1605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7228 -11.6813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6248 -11.1605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8205 -10.1187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7228 -8.5561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6248 -8.0352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5177 -9.9197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1302 -9.0769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7228 -9.5977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6248 -10.1187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5271 -9.5977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5271 -8.5561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3221 -7.1924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4200 -6.6716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1267 -7.1924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5177 -7.1924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2242 -6.6716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5177 -8.2342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1900 -7.9177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9184 -11.6813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8205 -11.1605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7950 -11.7932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2414 -12.2411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4144 -12.1853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8205 -9.0769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5111 -10.5125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6156 -6.6716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5271 -7.5143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0289 -6.6716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1267 -8.2342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2241 -5.6493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1310 -11.6716 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.6156 -5.6493 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7303 -7.1825 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.8245 -10.8639 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.1230 -9.0769 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2457 -11.1605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3606 -11.6716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2457 -10.1383 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.6193 -9.9366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6121 -9.9366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1230 -10.7964 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1601 -11.6016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4668 -12.5457 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1890 -11.3951 0.0000 C 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 2 0 0 0 0 11 6 1 0 0 0 0 12 11 1 0 0 0 0 12 5 2 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 9 37 1 6 0 0 10 38 1 6 0 0 39 40 1 0 0 0 39 41 2 0 0 0 34 39 1 0 0 0 38 42 1 0 0 0 42 43 1 0 0 0 42 44 2 0 0 0 37 45 1 0 0 0 45 46 2 0 0 0 45 47 1 0 0 0 M END > LMPR0106050023 > 3beta,15alpha,16alpha-triacetoxy dehydroeburicoic acid > 3beta,15alpha,16alpha-triacetoxy-24-methylene-lanosta-7,9(11)-dien-21-oic acid > C37H54O8 > 626.38 > Prenol Lipids [PR] > Isoprenoids [PR01] > C30 isoprenoids (triterpenes) [PR0106] > Lanostane triterpenoids [PR010605] > > KJXOSSJJWMOIFA-BZVVCASWSA-N > InChI=1S/C37H54O8/c1-20(2)21(3)12-13-25(33(41)42)30-31(44-23(5)39)32(45-24(6)40)37(11)27-14-15-28-34(7,8)29(43-22(4)38)17-18-35(28,9)26(27)16-19-36(30,37)10/h14,16,20,25,28-32H,3,12-13,15,17-19H2,1-2,4-11H3,(H,41,42)/t25-,28+,29+,30+,31+,32+,35-,36-,37-/m1/s1 > C1C[C@H](OC(=O)C)C(C)(C)[C@]2([H])CC=C3C([C@]21C)=CC[C@]1(C)[C@@]([H])([C@H](C(O)=O)CCC(=C)C(C)C)[C@H](OC(=O)C)[C@H](OC(C)=O)[C@]13C > - > - > - > - > - > - > - > - > - > - > - > - > 81056 > 41106788 $$$$