Search MNXref
 Feedback

compound 0197101

PropertiesImage
MNX_IDMNXM1181728 Image of MNXM1181728
referenceenvipathM:...1d3cb12cf710
formulaC37H66O10
global charge0
mol weight670.925
InChIKeyALKQUOLHKUTNTG-UHFFFAOYSA-N
InChIInChI=1S/C37H66O10/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-20-23-34(42)45-30(27-39)28-44-33(41)22-19-17-14-15-18-21-31-36(46-31)35(43)37-32(47-37)25-24-29(40)26-38/h5-6,29-32,35-40,43H,2-4,7-28H2,1H3
SMILESCCCCC=CCCCCCCCCCCC(=O)OC(CO)COC(=O)CCCCCCCC1OC1C(O)C1OC1CCC(O)CO
MNX internals
InChI (mnx)InChI=1/C37H66O10/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-20-23-34(42)45-30(27-39)28-44-33(41)22-19-17-14-15-18-21-31-36(46-31)35(43)37-32(47-37)25-24-29(40)26-38/h5-6,29-32,35-40,43H,2-4,7-28H2,1H3/b6-5?/t29?,30?,31?,32?,35?,36?,37? Image of MNXM1181728
SMILES (mnx)[CH3:1][CH2:2][CH2:3][CH2:4][CH:5]=[CH:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:16][CH2:20][CH2:23][C:34](=[O:42])[O:45][CH:30]([CH2:27][OH:39])[CH2:28][O:44][C:33]([CH2:22][CH2:19][CH2:17][CH2:14][CH2:15][CH2:18][CH2:21][CH:31]1[CH:36]([CH:35]([CH:37]2[CH:32]([CH2:25][CH2:24][CH:29]([CH2:26][OH:38])[OH:40])[O:47]2)[OH:43])[O:46]1)=[O:41]
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:...1d3cb12cf710
envipathM:...1d3cb12cf710
ALKQUOLHKUTNTG-UHFFFAOYSA-N
compound 0197101