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compound 0052890

PropertiesImage
MNX_IDMNXM1187253 Image of MNXM1187253
referenceenvipathM:...c96808655a9c
formulaC40H66O
global charge0
mol weight562.967
InChIKeySVPFYUIDQRGWJN-UHFFFAOYSA-N
InChIInChI=1S/C40H66O/c1-32(2)18-13-22-36(7)24-16-26-37(8)25-15-23-34(5)20-11-12-21-35(6)27-17-29-39(10)31-40(41)30-38(9)28-14-19-33(3)4/h11-12,19-21,24-25,29-30,32,40-41H,13-18,22-23,26-28,31H2,1-10H3
SMILESCC(C)=CCCC(C)=CC(O)CC(C)=CCCC(C)=CC=CC=C(C)CCC=C(C)CCC=C(C)CCCC(C)C
MNX internals
InChI (mnx)InChI=1/C40H66O/c1-32(2)18-13-22-36(7)24-16-26-37(8)25-15-23-34(5)20-11-12-21-35(6)27-17-29-39(10)31-40(41)30-38(9)28-14-19-33(3)4/h11-12,19-21,24-25,29-30,32,40-41H,13-18,22-23,26-28,31H2,1-10H3/b12-11?,34-20?,35-21?,36-24?,37-25?,38-30?,39-29?/t40? Image of MNXM1187253
SMILES (mnx)[CH3:1][CH:32]([CH3:2])[CH2:18][CH2:13][CH2:22][C:36]([CH3:7])=[CH:24][CH2:16][CH2:26][C:37]([CH3:8])=[CH:25][CH2:15][CH2:23][C:34]([CH3:5])=[CH:20][CH:11]=[CH:12][CH:21]=[C:35]([CH3:6])[CH2:27][CH2:17][CH:29]=[C:39]([CH3:10])[CH2:31][CH:40]([CH:30]=[C:38]([CH3:9])[CH2:28][CH2:14][CH:19]=[C:33]([CH3:3])[CH3:4])[OH: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:...c96808655a9c
envipathM:...c96808655a9c
SVPFYUIDQRGWJN-UHFFFAOYSA-N
compound 0052890