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(Q115972422)
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English
[(1Z,4R,7R,9R,10S,12E)-10-acetyloxy-2-benzyl-1,13-dichloro-7,9-dimethyltrideca-1,12-dien-4-yl] acetate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
482.199064992
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₆H₃₆Cl₂O₄
0 references
canonical SMILES
O=C(OC(CC(=CCl)CC=1C=CC=CC1)CCC(C)CC(C)C(OC(=O)C)CC=CCl)C
0 references
isomeric SMILES
CC(=O)O[C@H](CC[C@@H](C)C[C@@H](C)[C@H](C/C=C/Cl)OC(C)=O)C/C(=C\Cl)Cc1ccccc1
0 references
found in taxon
Trichodesmium thiebautii
1 reference
stated in
Isolation of Isotrichophycin C and Trichophycins G-I from a Collection of Trichodesmium thiebautii
Oscillatoria thiebautii
1 reference
stated in
Isolation of Isotrichophycin C and Trichophycins G-I from a Collection of Trichodesmium thiebautii
Identifiers
InChI
InChI=1S/C26H36Cl2O4/c1-19(15-20(2)26(11-8-14-27)32-22(4)30)12-13-25(31-21(3)29)17-24(18-28)16-23-9-6-5-7-10-23/h5-10,14,18-20,25-26H,11-13,15-17H2,1-4H3/b14-8+,24-18-/t19-,20-,25-,26+/m1/s1
0 references
InChIKey
KZZHQROVUBIQFD-VXUDHDTCSA-N
0 references
PubChem CID
162666319
2 references
stated in
PubChem
retrieved
3 January 2023
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
KZZHQROVUBIQFD-VXUDHDTCSA-N
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