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gossypol-6,6'-dimethyl ether

MNXM18262 is deprecated and here replaced by MNXM1106974
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM1106974 Image of MNXM1106974
referencemetacycM:CPD-9527
formulaC32H34O8
global charge0
mol weight546.616
InChIKeyOUHOXIPLBJIWEG-UHFFFAOYSA-N
InChIInChI=1S/C32H34O8/c1-13(2)21-17-9-15(5)23(29(37)25(17)19(11-33)27(35)31(21)39-7)24-16(6)10-18-22(14(3)4)32(40-8)28(36)20(12-34)26(18)30(24)38/h9-14,35-38H,1-8H3
SMILESCOC1=C(C(C)C)C2=CC(C)=C(C3=C(C)C=C4C(=C3O)C(C=O)=C(O)C(OC)=C4C(C)C)C(O)=C2C(C=O)=C1O
MNX internals
InChI (mnx)InChI=1/C32H34O8/c1-13(2)21-17-9-15(5)23(29(37)25(17)19(11-33)27(35)31(21)39-7)24-16(6)10-18-22(14(3)4)32(40-8)28(36)20(12-34)26(18)30(24)38/h9-14,35-38H,1-8H3 Image of MNXM1106974
SMILES (mnx)[CH3:1][CH:13]([CH3:2])[C:21]1=[C:17]2[CH:9]=[C:15]([CH3:5])[C:23]([C:24]3=[C:30]([OH:38])[C:26]4=[C:20]([CH:12]=[O:34])[C:28]([OH:36])=[C:32]([O:40][CH3:8])[C:22]([CH:14]([CH3:3])[CH3:4])=[C:18]4[CH:10]=[C:16]3[CH3:6])=[C:29]([OH:37])[C:25]2=[C:19]([CH:11]=[O:33])[C:27]([OH:35])=[C:31]1[O:39][CH3:7]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)3
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

metacyc.compound:CPD-9527
metacycM:CPD-9527
seed.compound:cpd25718
seedM:cpd25718
OUHOXIPLBJIWEG-UHFFFAOYSA-N 		gossypol-6,6'-dimethyl ether

seedM:M_cpd25718 		secondary/obsolete/fantasy identifier