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(Q105177189)
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English
Methyl 4-(19-chloro-17,18-dihydroxy-7,8,13-trimethyl-14-oxo-5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosa-2(9),15-dien-6-yl)-2,3-dimethylbut-2-enoate
group of stereoisomers with the chemical formula C₂₉H₃₉ClO₆
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Statements
instance of
group of stereoisomers
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subclass of
chemical compound
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mass
518.2435166479999
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₉H₃₉ClO₆
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canonical SMILES
O=C(OC)C(=C(C)CC1OC2CC3=C(CCC4C3CC(Cl)C5(O)C(O)C=CC(=O)C45C)C2(C)C1C)C
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Identifiers
InChI
InChI=1S/C29H39ClO6/c1-14(15(2)26(33)35-6)11-21-16(3)27(4)19-7-8-20-17(18(19)13-25(27)36-21)12-22(30)29(34)24(32)10-9-23(31)28(20,29)5/h9-10,16-17,20-22,24-25,32,34H,7-8,11-13H2,1-6H3
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InChIKey
NCGQAQYJKJBDEC-UHFFFAOYSA-N
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PubChem CID
73817607
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
NCGQAQYJKJBDEC-UHFFFAOYSA-N
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