(Q105291076)

English

(2,9,10-Triacetyloxy-13-chloro-8,17-dimethyl-12-methylidene-16-oxospiro[15,18-dioxatetracyclo[9.6.1.01,14.03,8]octadecane-4,2'-oxirane]-7-yl) acetate

group of stereoisomers with the chemical formula C₂₈H₃₅ClO₁₂

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Statements

instance of

group of stereoisomers

0 references

1 reference

598.18170424 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₈H₃₅ClO₁₂

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canonical SMILES

O=C(OC1C2OC3(C(OC(=O)C3C)C(Cl)C2=C)C(OC(=O)C)C4C5(OC5)CCC(OC(=O)C)C4(C)C1OC(=O)C)C

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found in taxon

Junceella fragilis

1 reference

stated in

Study on the chemical constituents of the South China Sea gorgonian Junceella juncea

Identifiers

InChI

InChI=1S/C28H35ClO12/c1-11-18(29)22-28(12(2)25(34)40-22)24(39-16(6)33)21-26(7,17(36-13(3)30)8-9-27(21)10-35-27)23(38-15(5)32)20(19(11)41-28)37-14(4)31/h12,17-24H,1,8-10H2,2-7H3

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InChIKey

VPXKDKFGKRSWEO-UHFFFAOYSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

VPXKDKFGKRSWEO-UHFFFAOYSA-N

1 reference

(Q105291076)

(2,9,10-Triacetyloxy-13-chloro-8,17-dimethyl-12-methylidene-16-oxospiro[15,18-dioxatetracyclo[9.6.1.01,14.03,8]octadecane-4,2'-oxirane]-7-yl) acetate

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Identifiers

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