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bioresmethrin
MNXM736212 is deprecated and here replaced by MNXM1371741
!!! Alternative mappings exist !!!
| Properties | Image |
MNX_ID | MNXM1371741 |
 |
reference | chebi:39280 |
formula | C22H26O3 |
global charge | 0 |
mol weight | 338.447 |
InChIKey | VEMKTZHHVJILDY-UXHICEINSA-N |
InChI | InChI=1S/C22H26O3/c1-15(2)10-19-20(22(19,3)4)21(23)25-14-17-12-18(24-13-17)11-16-8-6-5-7-9-16/h5-10,12-13,19-20H,11,14H2,1-4H3/t19-,20+/m1/s1 |
SMILES | CC(C)=C[C@@H]1[C@@H](C(=O)OCC2=COC(CC3=CC=CC=C3)=C2)C1(C)C |
MNX internals
InChI (mnx) | InChI=1/C22H26O3/c1-15(2)10-19-20(22(19,3)4)21(23)25-14-17-12-18(24-13-17)11-16-8-6-5-7-9-16/h5-10,12-13,19-20H,11,14H2,1-4H3/t19-,20+/m1/s1 |
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SMILES (mnx) | [CH3:1][C:15]([CH3:2])=[CH:10][C@@H:19]1[C@@H:20]([C:21](=[O:23])[O:25][CH2:14][C:17]2=[CH:13][O:24][C:18]([CH2:11][C:16]3=[CH:8][CH:6]=[CH:5][CH:7]=[CH:9]3)=[CH:12]2)[C:22]1([CH3:3])[CH3:4] |
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Parent-child relations graph |
Occurences in reactions | #reac |
in my sandbox |
0 |
in MNXref (generic) | 0 |
in models (compartimentalized) |
0 |
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Similar chemical compounds in external resources
Identifier | Description |
CHEBI:39280 chebi:39280 VEMKTZHHVJILDY-UXHICEINSA-N
| bioresmethrin (+)-trans-Resmethrin (5-benzylfuran-3-yl)methyl (1R,3R)-2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropanecarboxylate 1R-trans-Resemethrin 5-Benzyl-3-furylmethyl (+)-trans-chrysanthemate 5-Benzyl-3-furylmethyl (1R)-trans-chrysanthemate Biobenzyfuroline
|
seed.compound:cpd16570 seedM:cpd16570 kegg.compound:C16810 keggC:C16810 VEMKTZHHVJILDY-UXHICEINSA-N
| Bioresmethrin
|
keggC:M_C16810 seedM:M_cpd16570
| secondary/obsolete/fantasy identifier
|