(3b,6a,12b,17a,20S)-Dammar-24-ene-3,6,12,17,20-pentol 20-[glucosyl-(1->2)-[rhamnosyl-(1->6)]-glucoside] 6-glucoside

Properties Image MNX_ID MNXM115056 reference chebi:230900 formula C54H92O24 global charge 0 mol weight 1125.306 InChIKey XKRVXEKRWHROIF-UHFFFAOYSA-N InChI InChI=1S/C54H92O24/c1-22(2)11-10-13-53(9,78-48-42(77-47-41(69)37(65)33(61)27(20-56)75-47)38(66)34(62)28(76-48)21-71-45-39(67)35(63)31(59)23(3)72-45)54(70)16-15-51(7)43(54)24(57)17-29-50(6)14-12-30(58)49(4,5)44(50)25(18-52(29,51)8)73-46-40(68)36(64)32(60)26(19-55)74-46/h11,23-48,55-70H,10,12-21H2,1-9H3 SMILES CC(C)=CCCC(C)(OC1OC(COC2OC(C)C(O)C(O)C2O)C(O)C(O)C1OC1OC(CO)C(O)C(O)C1O)C1(O)CCC2(C)C1C(O)CC1C3(C)CCC(O)C(C)(C)C3C(OC3OC(CO)C(O)C(O)C3O)CC12C MNX internals InChI (mnx) InChI=1/C54H92O24/c1-22(2)11-10-13-53(9,78-48-42(77-47-41(69)37(65)33(61)27(20-56)75-47)38(66)34(62)28(76-48)21-71-45-39(67)35(63)31(59)23(3)72-45)54(70)16-15-51(7)43(54)24(57)17-29-50(6)14-12-30(58)49(4,5)44(50)25(18-52(29,51)8)73-46-40(68)36(64)32(60)26(19-55)74-46/h11,23-48,55-70H,10,12-21H2,1-9H3/t23?,24?,25?,26?,27?,28?,29?,30?,31?,32?,33?,34?,35?,36?,37?,38?,39?,40?,41?,42?,43?,44?,45?,46?,47?,48?,50?,51?,52?,53?,54? SMILES (mnx) [CH3:1][C:22]([CH3:2])=[CH:11][CH2:10][CH2:13][C:53]([CH3:9])([C:54]1([OH:70])[CH2:16][CH2:15][C:51]2([CH3:7])[CH:43]1[CH:24]([OH:57])[CH2:17][CH:29]1[C:50]3([CH3:6])[CH2:14][CH2:12][CH:30]([OH:58])[C:49]([CH3:4])([CH3:5])[CH:44]3[CH:25]([O:73][CH:46]3[CH:40]([OH:68])[CH:36]([OH:64])[CH:32]([OH:60])[CH:26]([CH2:19][OH:55])[O:74]3)[CH2:18][C:52]12[CH3:8])[O:78][CH:48]1[CH:42]([O:77][CH:47]2[CH:41]([OH:69])[CH:37]([OH:65])[CH:33]([OH:61])[CH:27]([CH2:20][OH:56])[O:75]2)[CH:38]([OH:66])[CH:34]([OH:62])[CH:28]([CH2:21][O:71][CH:45]2[CH:39]([OH:67])[CH:35]([OH:63])[CH:31]([OH:59])[CH:23]([CH3:3])[O:72]2)[O:76]1

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0