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compound 0144089

PropertiesImage
MNX_IDMNXM1187817 Image of MNXM1187817
referenceenvipathM:...a0442a2fee38
formulaC41H70O11
global charge-2
mol weight739
InChIKeyZXYIOXJBQOYQNQ-UHFFFAOYSA-L
InChIInChI=1S/C41H72O11/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-23-28-40(47)51-34(31-43)32-50-39(46)27-22-17-14-15-20-25-36-37(52-36)26-21-18-19-24-33(30-42)35(41(48)49)29-38(44)45/h8-9,33-37,42-43H,2-7,10-32H2,1H3,(H,44,45)(H,48,49)/p-2
SMILESCCCCCCCC=CCCCCCCCC(=O)OC(CO)COC(=O)CCCCCCCC1OC1CCCCCC(CO)C(CC(=O)[O-])C(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C41H72O11/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-23-28-40(47)51-34(31-43)32-50-39(46)27-22-17-14-15-20-25-36-37(52-36)26-21-18-19-24-33(30-42)35(41(48)49)29-38(44)45/h8-9,33-37,42-43H,2-7,10-32H2,1H3,(H,44,45)(H,48,49)/b9-8?/t33?,34?,35?,36?,37? Image of MNXM1187817
SMILES (mnx)[CH3:1][CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH:8]=[CH:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:16][CH2:23][CH2:28][C:40](=[O:47])[O:51][CH:34]([CH2:31][OH:43])[CH2:32][O:50][C:39]([CH2:27][CH2:22][CH2:17][CH2:14][CH2:15][CH2:20][CH2:25][CH:36]1[CH:37]([CH2:26][CH2:21][CH2:18][CH2:19][CH2:24][CH:33]([CH2:30][OH:42])[CH:35]([CH2:29][C:38](=[O:44])[OH:45])[C:41](=[O:48])[OH:49])[O:52]1)=[O:46]
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:...a0442a2fee38
envipathM:...a0442a2fee38
ZXYIOXJBQOYQNQ-UHFFFAOYSA-L
compound 0144089