Search MNXref
 Feedback

compound 0064697

PropertiesImage
MNX_IDMNXM1184724 Image of MNXM1184724
referenceenvipathM:...ab2919271d8a
formulaC26H40O4
global charge0
mol weight416.602
InChIKeyDMYAQAUQXJZGEH-UHFFFAOYSA-N
InChIInChI=1S/C26H40O4/c1-4-5-6-7-8-23(29)30-18-11-13-25(2)17(15-18)16-21(27)24-19-9-10-22(28)26(19,3)14-12-20(24)25/h16,18-21,24,27H,4-15H2,1-3H3
SMILESCCCCCCC(=O)OC1CCC2(C)C(=CC(O)C3C4CCC(=O)C4(C)CCC32)C1
MNX internals
InChI (mnx)InChI=1/C26H40O4/c1-4-5-6-7-8-23(29)30-18-11-13-25(2)17(15-18)16-21(27)24-19-9-10-22(28)26(19,3)14-12-20(24)25/h16,18-21,24,27H,4-15H2,1-3H3/t18?,19?,20?,21?,24?,25?,26? Image of MNXM1184724
SMILES (mnx)[CH3:1][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][C:23](=[O:29])[O:30][CH:18]1[CH2:11][CH2:13][C:25]2([CH3:2])[C:17](=[CH:16][CH:21]([OH:27])[CH:24]3[CH:19]4[CH2:9][CH2:10][C:22](=[O:28])[C:26]4([CH3:3])[CH2:14][CH2:12][CH:20]32)[CH2:15]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:...ab2919271d8a
envipathM:...ab2919271d8a
DMYAQAUQXJZGEH-UHFFFAOYSA-N
compound 0064697