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compound 0175187

PropertiesImage
MNX_IDMNXM1194179 Image of MNXM1194179
referenceenvipathM:...4648d41dee24
formulaC37H64O10
global charge0
mol weight668.909
InChIKeyOUJOIUXCXDTWTI-UHFFFAOYSA-N
InChIInChI=1S/C37H64O10/c1-3-5-7-8-15-21-31-36(46-31)28(39)18-13-9-11-16-22-34(41)43-25-27(38)26-44-35(42)23-17-12-10-14-19-29(40)37-33(47-37)24-32-30(45-32)20-6-4-2/h27-28,30-33,36-39H,3-26H2,1-2H3
SMILESCCCCCCCC1OC1C(O)CCCCCCC(=O)OCC(O)COC(=O)CCCCCCC(=O)C1OC1CC1OC1CCCC
MNX internals
InChI (mnx)InChI=1/C37H64O10/c1-3-5-7-8-15-21-31-36(46-31)28(39)18-13-9-11-16-22-34(41)43-25-27(38)26-44-35(42)23-17-12-10-14-19-29(40)37-33(47-37)24-32-30(45-32)20-6-4-2/h27-28,30-33,36-39H,3-26H2,1-2H3/t27?,28?,30?,31?,32?,33?,36?,37? Image of MNXM1194179
SMILES (mnx)[CH3:1][CH2:3][CH2:5][CH2:7][CH2:8][CH2:15][CH2:21][CH:31]1[CH:36]([CH:28]([CH2:18][CH2:13][CH2:9][CH2:11][CH2:16][CH2:22][C:34](=[O:41])[O:43][CH2:25][CH:27]([CH2:26][O:44][C:35]([CH2:23][CH2:17][CH2:12][CH2:10][CH2:14][CH2:19][C:29]([CH:37]2[CH:33]([CH2:24][CH:32]3[CH:30]([CH2:20][CH2:6][CH2:4][CH3:2])[O:45]3)[O:47]2)=[O:40])=[O:42])[OH:38])[OH:39])[O:46]1
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:...4648d41dee24
envipathM:...4648d41dee24
OUJOIUXCXDTWTI-UHFFFAOYSA-N
compound 0175187