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compound 0154509

PropertiesImage
MNX_IDMNXM1182181 Image of MNXM1182181
referenceenvipathM:...dcfee1ebb724
formulaC37H64O10
global charge0
mol weight668.909
InChIKeyMTRAFCVRDSAJOH-UHFFFAOYSA-N
InChIInChI=1S/C37H64O10/c38-24-16-9-3-6-11-19-31-30(45-31)18-10-4-1-7-13-22-36(41)43-27-29(40)28-44-37(42)23-14-8-2-5-12-20-32-34(46-32)26-35-33(47-35)21-15-17-25-39/h24,29-35,39-40H,1-23,25-28H2
SMILESO=CCCCCCCC1OC1CCCCCCCC(=O)OCC(O)COC(=O)CCCCCCCC1OC1CC1OC1CCCCO
MNX internals
InChI (mnx)InChI=1/C37H64O10/c38-24-16-9-3-6-11-19-31-30(45-31)18-10-4-1-7-13-22-36(41)43-27-29(40)28-44-37(42)23-14-8-2-5-12-20-32-34(46-32)26-35-33(47-35)21-15-17-25-39/h24,29-35,39-40H,1-23,25-28H2/t29?,30?,31?,32?,33?,34?,35? Image of MNXM1182181
SMILES (mnx)[CH2:1]([CH2:4][CH2:10][CH2:18][CH:30]1[CH:31]([CH2:19][CH2:11][CH2:6][CH2:3][CH2:9][CH2:16][CH:24]=[O:38])[O:45]1)[CH2:7][CH2:13][CH2:22][C:36](=[O:41])[O:43][CH2:27][CH:29]([CH2:28][O:44][C:37]([CH2:23][CH2:14][CH2:8][CH2:2][CH2:5][CH2:12][CH2:20][CH:32]1[CH:34]([CH2:26][CH:35]2[CH:33]([CH2:21][CH2:15][CH2:17][CH2:25][OH:39])[O:47]2)[O:46]1)=[O:42])[OH: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:...dcfee1ebb724
envipathM:...dcfee1ebb724
MTRAFCVRDSAJOH-UHFFFAOYSA-N
compound 0154509