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Acutilol A

PropertiesImage
MNX_IDMNXM40205 Image of MNXM40205
referencechebi:2451
formulaC20H32O2
global charge0
mol weight304.474
InChIKeyYBQDGKYVLDZIDN-SGKAGNBOSA-N
InChIInChI=1S/C20H32O2/c1-12-6-10-16(13(2)8-11-17-20(4,5)22-17)19(21)18-14(3)7-9-15(12)18/h7,13,16-19,21H,6,8-11H2,1-5H3/t13-,16+,17?,18-,19-/m1/s1
SMILESCC1=CCC2=C(C)CC[C@@H]([C@H](C)CCC3OC3(C)C)[C@@H](O)[C@H]12
MNX internals
InChI (mnx)InChI=1/C20H32O2/c1-12-6-10-16(13(2)8-11-17-20(4,5)22-17)19(21)18-14(3)7-9-15(12)18/h7,13,16-19,21H,6,8-11H2,1-5H3/t13-,16+,17?,18-,19-/m1/s1 Image of MNXM40205
SMILES (mnx)[CH3:1][C:12]1=[C:15]2[CH2:9][CH:7]=[C:14]([CH3:3])[C@H:18]2[C@H:19]([OH:21])[C@H:16]([C@H:13]([CH3:2])[CH2:8][CH2:11][CH:17]2[C:20]([CH3:4])([CH3:5])[O:22]2)[CH2:10][CH2:6]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

seed.compound:cpd05953
seedM:cpd05953
CHEBI:2451
chebi:2451
kegg.compound:C09057
keggC:C09057
lipidmaps:LMPR0104470001
lipidmapsM:LMPR0104470001
YBQDGKYVLDZIDN-SGKAGNBOSA-N 		Acutilol A

keggC:M_C09057
seedM:M_cpd05953 		secondary/obsolete/fantasy identifier