LMPR0106150029 LIPID_MAPS_STRUCTURE_DATABASE 35 39 0 0 0 0 0 0 0 0999 V2000 6.2699 7.2048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2699 6.3756 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9810 5.9647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9810 7.6231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6991 7.2048 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7005 6.3756 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.4152 5.9674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1310 6.3781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4122 7.6220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1271 7.2067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1271 8.8587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4096 8.4468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8421 8.4473 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.8363 7.6236 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.5429 7.2080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2613 7.6136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5543 8.8557 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.2627 8.4381 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.9754 8.8433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9843 9.6647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2759 10.0824 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.5544 9.6785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3867 5.2475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6891 8.0301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9770 8.0283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8292 6.7995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5574 5.2475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5544 5.9626 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6985 5.5521 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5483 8.0301 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8380 9.2742 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8570 10.7988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6814 10.7988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5020 10.8060 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2590 11.5082 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 2 28 1 1 0 0 0 2 3 1 0 0 0 0 3 23 1 0 0 0 0 3 27 1 0 0 0 0 3 6 1 0 0 0 0 5 4 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 24 1 1 0 0 0 6 7 1 0 0 0 0 6 29 1 6 0 0 0 7 8 1 0 0 0 0 8 10 2 0 0 0 0 9 10 1 0 0 0 0 9 12 2 0 0 0 0 10 14 1 0 0 0 0 13 11 1 0 0 0 0 11 12 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 13 31 1 6 0 0 0 14 15 1 0 0 0 0 14 26 1 1 0 0 0 15 16 1 0 0 0 0 16 18 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 30 1 1 0 0 0 18 19 1 0 0 0 0 18 25 1 1 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 32 1 1 0 0 0 21 33 1 0 0 0 0 33 34 1 0 0 0 0 33 35 2 0 0 0 0 M END > LMPR0106150029 > > (20R)-3beta-hydroxy-D:C-friedoolean-7,9(11)-dien-29-oic acid > C30H46O3 > 454.34 > Prenol Lipids [PR] > Isoprenoids [PR01] > C30 isoprenoids (triterpenes) [PR0106] > Oleanane triterpenoids [PR010615] > > MKJSCJNRPNXEGW-FPLINDMSSA-N > InChI=1S/C30H46O3/c1-25(2)21-9-8-20-19(28(21,5)12-11-23(25)31)10-13-30(7)22-18-27(4,24(32)33)15-14-26(22,3)16-17-29(20,30)6/h8,10,21-23,31H,9,11-18H2,1-7H3,(H,32,33)/t21-,22+,23-,26+,27+,28+,29+,30-/m0/s1 > C1C[C@]2(C)C3=CC[C@@]4(C)[C@]5([H])C[C@@](C(=O)O)(C)CC[C@]5(C)CC[C@]4(C)C3=CC[C@@]2([H])C(C)(C)[C@H]1O > - > - > 71468 > - > - > - > 70680340 > - > - > - > - > - > - > - $$$$