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compound 0276900

PropertiesImage
MNX_IDMNXM1175018 Image of MNXM1175018
referenceenvipathM:...2b2f0e13463f
formulaC41H60O14
global charge0
mol weight776.917
InChIKeyJWLQOXZQBIQMHL-UHFFFAOYSA-N
InChIInChI=1S/C41H60O14/c1-19-26(23-12-34(47)49-18-23)8-9-29(42)27-7-6-24-13-25(10-11-41(24,5)28(27)14-30(19)43)53-35-16-32(45)39(21(3)51-35)55-37-17-33(46)40(22(4)52-37)54-36-15-31(44)38(48)20(2)50-36/h19-28,33,35-40,46,48H,6-18H2,1-5H3
SMILESCC1OC(OC2C(O)CC(OC3C(=O)CC(OC4CCC5(C)C(CCC6C(=O)CCC(C7COC(=O)C7)C(C)C(=O)CC65)C4)OC3C)OC2C)CC(=O)C1O
MNX internals
InChI (mnx)InChI=1/C41H60O14/c1-19-26(23-12-34(47)49-18-23)8-9-29(42)27-7-6-24-13-25(10-11-41(24,5)28(27)14-30(19)43)53-35-16-32(45)39(21(3)51-35)55-37-17-33(46)40(22(4)52-37)54-36-15-31(44)38(48)20(2)50-36/h19-28,33,35-40,46,48H,6-18H2,1-5H3/t19?,20?,21?,22?,23?,24?,25?,26?,27?,28?,33?,35?,36?,37?,38?,39?,40?,41? Image of MNXM1175018
SMILES (mnx)[CH3:1][CH:19]1[CH:26]([CH:23]2[CH2:12][C:34](=[O:47])[O:49][CH2:18]2)[CH2:8][CH2:9][C:29](=[O:42])[CH:27]2[CH2:7][CH2:6][CH:24]3[CH2:13][CH:25]([O:53][CH:35]4[CH2:16][C:32](=[O:45])[CH:39]([O:55][CH:37]5[CH2:17][CH:33]([OH:46])[CH:40]([O:54][CH:36]6[CH2:15][C:31](=[O:44])[CH:38]([OH:48])[CH:20]([CH3:2])[O:50]6)[CH:22]([CH3:4])[O:52]5)[CH:21]([CH3:3])[O:51]4)[CH2:10][CH2:11][C:41]3([CH3:5])[CH:28]2[CH2:14][C:30]1=[O:43]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

envipath:...2b2f0e13463f
envipathM:...2b2f0e13463f
JWLQOXZQBIQMHL-UHFFFAOYSA-N
compound 0276900