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compound 0161513

PropertiesImage
MNX_IDMNXM1179739 Image of MNXM1179739
referenceenvipathM:...535078332766
formulaC37H64O10
global charge0
mol weight668.909
InChIKeyRHTVHWHJSAJYNE-UHFFFAOYSA-N
InChIInChI=1S/C37H64O10/c1-3-5-7-8-10-14-19-29(39)37(43)30(40)20-15-13-18-24-36(42)45-28(26-38)27-44-35(41)23-17-12-9-11-16-22-32-34(47-32)25-33-31(46-33)21-6-4-2/h8,10,28-29,31-34,37-39,43H,3-7,9,11-27H2,1-2H3
SMILESCCCCC=CCCC(O)C(O)C(=O)CCCCCC(=O)OC(CO)COC(=O)CCCCCCCC1OC1CC1OC1CCCC
MNX internals
InChI (mnx)InChI=1/C37H64O10/c1-3-5-7-8-10-14-19-29(39)37(43)30(40)20-15-13-18-24-36(42)45-28(26-38)27-44-35(41)23-17-12-9-11-16-22-32-34(47-32)25-33-31(46-33)21-6-4-2/h8,10,28-29,31-34,37-39,43H,3-7,9,11-27H2,1-2H3/b10-8?/t28?,29?,31?,32?,33?,34?,37? Image of MNXM1179739
SMILES (mnx)[CH3:1][CH2:3][CH2:5][CH2:7][CH:8]=[CH:10][CH2:14][CH2:19][CH:29]([CH:37]([C:30]([CH2:20][CH2:15][CH2:13][CH2:18][CH2:24][C:36](=[O:42])[O:45][CH:28]([CH2:26][OH:38])[CH2:27][O:44][C:35]([CH2:23][CH2:17][CH2:12][CH2:9][CH2:11][CH2:16][CH2:22][CH:32]1[CH:34]([CH2:25][CH:33]2[CH:31]([CH2:21][CH2:6][CH2:4][CH3:2])[O:46]2)[O:47]1)=[O:41])=[O:40])[OH:43])[OH:39]
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:...535078332766
envipathM:...535078332766
RHTVHWHJSAJYNE-UHFFFAOYSA-N
compound 0161513