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compound 0121495

PropertiesImage
MNX_IDMNXM1179046 Image of MNXM1179046
referenceenvipathM:...f3d097932e2f
formulaC37H66O9
global charge0
mol weight654.926
InChIKeyCILPXXQJFOAVIJ-UHFFFAOYSA-N
InChIInChI=1S/C37H66O9/c1-3-5-7-10-16-22-32-33(45-32)23-17-12-9-14-19-25-37(42)44-28-29(38)27-43-36(41)24-18-13-8-11-15-20-30(39)31(40)26-35-34(46-35)21-6-4-2/h29-30,32-35,38-39H,3-28H2,1-2H3
SMILESCCCCCCCC1OC1CCCCCCCC(=O)OCC(O)COC(=O)CCCCCCCC(O)C(=O)CC1OC1CCCC
MNX internals
InChI (mnx)InChI=1/C37H66O9/c1-3-5-7-10-16-22-32-33(45-32)23-17-12-9-14-19-25-37(42)44-28-29(38)27-43-36(41)24-18-13-8-11-15-20-30(39)31(40)26-35-34(46-35)21-6-4-2/h29-30,32-35,38-39H,3-28H2,1-2H3/t29?,30?,32?,33?,34?,35? Image of MNXM1179046
SMILES (mnx)[CH3:1][CH2:3][CH2:5][CH2:7][CH2:10][CH2:16][CH2:22][CH:32]1[CH:33]([CH2:23][CH2:17][CH2:12][CH2:9][CH2:14][CH2:19][CH2:25][C:37](=[O:42])[O:44][CH2:28][CH:29]([CH2:27][O:43][C:36]([CH2:24][CH2:18][CH2:13][CH2:8][CH2:11][CH2:15][CH2:20][CH:30]([C:31]([CH2:26][CH:35]2[CH:34]([CH2:21][CH2:6][CH2:4][CH3:2])[O:46]2)=[O:40])[OH:39])=[O:41])[OH:38])[O:45]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:...f3d097932e2f
envipathM:...f3d097932e2f
CILPXXQJFOAVIJ-UHFFFAOYSA-N
compound 0121495