SmilesFragFp 2D-Structure of C(C(CC(C(CO)O)O)=O)=O 3D-Structure of C(C(CC(C(CO)O)O)=O)=O (systematic torsions, mmff94s+) Structure of C(C(CC(C(CO)O)O)=O)=O C(C(CC(C(CO)O)O)=O)=O MMFF94 Energy xvojgyoX_DXu1VhVb2hc45J0nN8FHN4102!m502!2FFZFV!XF#101#W%J8$4#4$@050 !R?`BH@k\B?`BH?[_}?g~H@k\BbOvryB` #q\hKTHWOT@@BErWDqT_UD}bqPnzJ@clnhuZ[b{?nuWmyiE~{lAfCHbRvntxV{b^x?j{[HA}teuah@]~ME{Gjj_K\]VImAimYa`XhLwJ^j|urV]RwawfVlPtcRJTgaSb|dqWYn_Qdmkzje`o]mJ}oWwl^qMFuq{_eFTJih@O@At@@ dmTJ@@KiUIf^]jjf@@ C(CC(C(C(CO)O)O)=O)=O 37.425 xvojgyoXb@2u1VxVb0ge4Zo0rN8FF84G02!s5$60F4FV!VGF!101#1$80c)408!@050 !R?`Bw@h`B?`Bw?Xc}mpK~_x`BbOvryB` #q^qPUejGMvZzZJYI?JacYR`|biJKWYMamGd~rBQYmLyFjPP@@^DVGPchsCrPE?KdJkvyV{?wrbPD^Wd?`H?KQl?pqfLyxeGHyFfqiC_}YkquqRcmeRtuOX|pFMGOmFgUFwGFdcEzIUPqsyX\YXzMEk\mYSmKfpcZvdJjh@B@@`@@ dmTJ@@KaWHhhlhVjfh@@ C(C(C(CC(CO)O)=O)O)=O 42.821 xvojgyoX7@2u1VxV_0Ze4Zo0rO8FF84G$s1$Z0FZF#VGF!1010V&808)4$@050 !R?`Bw@h`B?`Bw?Xc}mpK~_x`BbOvryB` #qXcnbOhY]nUN]\DSaGIV[UqjcD?_UlTwbv_FaZg??w\jHS}gbEXbDMel]WpnrN~uyzb@C^Q`uzAYraruUGOJowD]r|hXX{`g[Kp_R@TzAJTv\SPhMXhtZ`v?MC|vD]NCAosy}WjKxX]iIWF?Z\`jWx}RQKMp[wFgNHJjH@V@Ab@D dmTJ@@KaWHhhlhVjjd@@ C(CC(C=O)O)(C(CO)O)=O 52.035 xvojgyoX7@2u1VxV_0_e4ZJ0KO8FH841$s102!Z0FZF#VFF!1010V&848$4#Z$@050 !R?`BH@k\B?`BH?[_}?g~H@k\BbOvryB` #qUHI[uLuyLuVG@@?VstCCB[RuiEV@GoW`ib]FflCKbhz{[y\}`?_}mVrZeGX?qW??ZQA|tPceMOc[zZGUHbropitQfLKNGctlTq[CGAf}ykdz|s_VXqGJ~GN~tuvhxX\s\ldzdxGBUbDn]gKT[@oSOj_mtUx`twQUxJhP@H`@l@D dmTJ@@KiUIf^]jji@@ C(C(C(C=O)O)O)(CCO)=O 50.093 xvojgyoXb@2u1VxVb0he4_J0KF8FH841$k502!6JFZN#VF0V#1)848$4#4$@050 !R?g~w?Xc}mpJH@ox@bOw~_x`BbOvrmGD #qtuOljo_]wh_eOAORZe{\xW??p^EhrZ|PYHr\qJ_UnMvnj@anBKhKBYd?RbHfNJBe\FqsEvEqyBTvvr]E\`ofVWyeYDxZiFeqDhYRjw|iOzlI{duEVLp`rRufT|pmGlMR``ZPljv]_uO[xVemH{qMKhgrXNPz{dWFXJk@@W@@n@D dmTJ@@IaUIe{mjji@@ C(C(C(CC(CO)=O)O)O)=O 56.143 xvojBykXWD2m0VhVY0Wc05K0KF8FHN&m402440F0ZN!F0F0V#1#V$8J8$4#4$@050 !Rb@JH?_x@?g~H@ox@bOw~_x`BbOvrSA@ #qmHnjpmPY`z]JCTPCQ@FgpArfVb\l?Ox^}qdQgpPZoaPyL}Pe_?Gd|P@@YOgKStqVlmoRsAqJemYPUBfR~N[tP^R[sXsEecDjpNO_uitR_jG^|aqshF{rwJ@uyKLxn^qUoArDQo}FaXpHchFJxLjymZPmYnooZUYiRJkX@T@A@@@ dmTJ@@IaWHhhYifjjd@@ C(C(C(C(C(C)=O)O)O)O)=O 76.482 xvoEBTkX1D2m0VhVY0Wc05K0rF8FHN&m402440F0ZN80F2F%1#V$8J%4#4$@050 !RbOvH@ox@bOw~_x`B?`BH?X`BbOvr{@@ #qgACG}lHNMtRAQeFO_yBxHnBrJMi??uDSSOaN^n`gmL}otvNCmLKAMpYcx`nDmLiG@t}p\u{m@YEhgzKnOhil\]AxRkU@{IaCq[rNLY^ca}J?P}_\Dfz{byOM]`N[UUOLxYM[{\Sy{lHxAkpkAeWYEL_ryeMMhdCmVJkH@E@Av@D dmTJ@@rnUI[nujji@@ C(CC(C(C(C=O)O)O)O)=O 49.588 oFk44&F////*4$@050 !R@AL@[@@Slo`@ #qFppL[CXEEphnFGGt@@CiMd@IZck@`RC{RHe[Z\Gx^HwjuA[id|zqjbnsx|kH@J`@`@@ gC``AdeZ@@ C(CO)=O 23.649 xvkEBLkX0D2k0VCVY0WV04F01F8FHF&m402%VF$F%1#V%J%4#4$@050 !RbOvH@ox@bOw~_x`BbOvrm@@ #qT[iKHrzScUx\qg???BouH}`}|a@lnV|MfTFikiD?rHRb}LuJ@|c[AUAMlZZ]F?of{jeUIDyqPCMgqnGfaqX~VvIvenNly[_ionyCHYvDqPe_iFBY]_GeD_]KERkH@N@AA@D daxB@@rnRV{Zj`@ C(C(C(CO)O)O)=O 53.417 xvojgyqXbEXu8VxVb2he4_K1pNcFHN41$m412446JFZN!FXN#101#V04!8J8!104#4$2010 !R?g~H?[_}?g~H@k\B?`BH?_y?b@JH?[Jt\P #qAuOaymI\_fXlehu@bS~BGl[EyIwCjtu|@@@DHUPf{mFwgbH_uehmKwQqIxpemHcCLramgghbzGV~XOrQxmgLj`^H[BVbmMRVKzVLsFWZzkV|tpJFfqJB_]WnZz{PC`DdLvHzs[wycBy`LRFKkSYsa[TkWFIGEaMmw?sLxg|eDSO`OflmfCqWtZrJUrk@@K@@j@@ dctF@@Ing\bbbtLsUUU@@ C(CO)(C(C(C(CO)O)O)O)=O 91.238 zj_DtTaXLju2ieo0VX_DKa_4Fm_0HR0oGV08k01F4Z!G!F1!J0G!2$V.V&2010 !R?g|_FaaSGvUSYvU`YQ}??eRDwzYeXKH@@@ #qf]]aqajBa_bf`YBTzqMQkI{ciejLPkXpeIt?mcD`RRR_nFsyjin~OeQdRBW]csJJj?`mHPdtiphz\W??rimyIankOXtFR}uvvJjkzq\azHkFgG^IdfYVqDyI]NIgJbZ|eUTBEET^PSOI[`HUMer\qTNZLAHu@`tiNRqUp`cqdOkuVywqllOMkPpN|jhP@A@@L@@ dcLF@@sag\dTTrTiUUUUT@@ C(C(C1C(C(C(O)O1)O)O)O)O 94.799 zj_DtTaeLju2yeoFVX_DSa_4Fk_8HN0o1c08kV1F4Z!O#1!F01$F!V!2%1,2010 !R?g~w@ha}m?vw__x@?g~w?K_|b@Jw?[H@@@ #qATHBcoCwe^rV_RzTdKOA?LIst@YCg}t]nbY???WUgzO{_kQPnK^tw\?E^isH\{[d`}\VH}}qvwEaxF`ZlyCJbdJN`?PNdeZN@KQkLgkN[xuio^leJcJACh~K~NJx]Se|gYloi^MQJPjQcWA\qJW`^]alTI{UVureh{g[j_\LQ_edJj|cQ}K}PxmV^jjP@G@A`@D dcLF@@siWTify^ajjjj@@ C(C1C(C(C(C(O)O1)O)O)O)O 87.416 zj_DtTaeLjm3yeoFVX_DJZ_4NmZ8HRFo1V!k01F4Z!O!F#F01(V4+F)2010 !R?g}GCKAmQwO_v\[_w|YsNFvO\t]??kH@@@ #qKLd`gz`UetzyiLO[z?v]oQ@DCNLkJSP_?c?EdojEbwe??|bQkv|MkDnQNkXFLD[]ISOK|wYkptM]HZ{pavHLodyoovSXm_caanIZ{@tZlKIua\ksb@nPFeM~NjKTM`EsBBuw]iptsoF]V[_T}ivHm_tcPmY[r]TkoQouRk}QsTnrqkDIbatZiPa]AjhH@T@Ar@D dcLF@@qaWTigfijjjj@@ C1C(C(C(C(C(O)O1)O)O)O)O 99.413