Search MNXref
 Feedback

7-demethoxyegonol oleate

PropertiesImage
MNX_IDMNXM102160 Image of MNXM102160
referencechebi:69549
formulaC36H48O5
global charge0
mol weight560.775
InChIKeyGIGIGVBVJACSBJ-KTKRTIGZSA-N
InChIInChI=1S/C36H48O5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-36(37)38-24-17-18-29-20-22-32-31(25-29)27-34(41-32)30-21-23-33-35(26-30)40-28-39-33/h9-10,20-23,25-27H,2-8,11-19,24,28H2,1H3/b10-9-
SMILESCCCCCCCC/C=C\CCCCCCCC(=O)OCCCC1=CC=C2OC(C3=CC=C4OCOC4=C3)=CC2=C1
MNX internals
InChI (mnx)InChI=1/C36H48O5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-36(37)38-24-17-18-29-20-22-32-31(25-29)27-34(41-32)30-21-23-33-35(26-30)40-28-39-33/h9-10,20-23,25-27H,2-8,11-19,24,28H2,1H3/b10-9- Image of MNXM102160
SMILES (mnx)[CH3:1][CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8]/[CH:9]=[CH:10]\[CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:19][C:36](=[O:37])[O:38][CH2:24][CH2:17][CH2:18][C:29]1=[CH:25][C:31]2=[C:32]([CH:22]=[CH:20]1)[O:41][C:34]([C:30]1=[CH:26][C:35]3=[C:33]([CH:23]=[CH:21]1)[O:39][CH2:28][O:40]3)=[CH:27]2
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

CHEBI:69549
chebi:69549
GIGIGVBVJACSBJ-KTKRTIGZSA-N
7-demethoxyegonol oleate
3-[2-(1,3-benzodioxol-5-yl)-1-benzofuran-5-yl]propyl (9Z)-octadec-9-enoate