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compound 0154238

PropertiesImage
MNX_IDMNXM1186784 Image of MNXM1186784
referenceenvipathM:...e3b374b65910
formulaC37H70O9
global charge0
mol weight658.958
InChIKeyIRKNUBOVIHBWPR-UHFFFAOYSA-N
InChIInChI=1S/C37H70O9/c1-3-5-7-8-9-10-11-12-13-14-15-16-19-23-27-34(41)45-30(28-38)29-44-33(40)26-22-20-17-18-21-25-32-37(46-32)36(43)35(42)31(39)24-6-4-2/h30-32,35-39,42-43H,3-29H2,1-2H3
SMILESCCCCCCCCCCCCCCCCC(=O)OC(CO)COC(=O)CCCCCCCC1OC1C(O)C(O)C(O)CCCC
MNX internals
InChI (mnx)InChI=1/C37H70O9/c1-3-5-7-8-9-10-11-12-13-14-15-16-19-23-27-34(41)45-30(28-38)29-44-33(40)26-22-20-17-18-21-25-32-37(46-32)36(43)35(42)31(39)24-6-4-2/h30-32,35-39,42-43H,3-29H2,1-2H3/t30?,31?,32?,35?,36?,37? Image of MNXM1186784
SMILES (mnx)[CH3:1][CH2:3][CH2:5][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:19][CH2:23][CH2:27][C:34](=[O:41])[O:45][CH:30]([CH2:28][OH:38])[CH2:29][O:44][C:33]([CH2:26][CH2:22][CH2:20][CH2:17][CH2:18][CH2:21][CH2:25][CH:32]1[CH:37]([CH:36]([CH:35]([CH:31]([CH2:24][CH2:6][CH2:4][CH3:2])[OH:39])[OH:42])[OH:43])[O:46]1)=[O:40]
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:...e3b374b65910
envipathM:...e3b374b65910
IRKNUBOVIHBWPR-UHFFFAOYSA-N
compound 0154238