(Q105350704)

English

methyl 2-[(1R,2S,7R,10S,13S)-13-methoxy-1,7,10-trimethyl-6-methylidene-15-oxo-11,14-dioxatetracyclo[8.7.0.02,7.012,16]heptadec-12(16)-en-13-yl]acetate

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

Methyl 2-(13-methoxy-1,7,10-trimethyl-6-methylidene-15-oxo-11,14-dioxatetracyclo[8.7.0.02,7.012,16]heptadec-12(16)-en-13-yl)acetate

1 reference

based on heuristic

inferred from SMILES

mass

404.219888744 dalton

1 reference

2 references

inferred from InChIKey

based on heuristic

inferred from InChI

methyl 2-[(1R,2S,7R,10S,13R)-13-methoxy-1,7,10-trimethyl-6-methylidene-15-oxo-11,14-dioxatetracyclo[8.7.0.02,7.012,16]heptadec-12(16)-en-13-yl]acetate

2 references

based on heuristic

inferred from InChIKey

2 references

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₂₃H₃₂O₆

0 references

canonical SMILES

O=C1OC(OC)(C=2OC3(C)CCC4(C(=C)CCCC4C3(C)CC12)C)CC(=O)OC

0 references

isomeric SMILES

C=C1CCC[C@H]2[C@@]1(C)CC[C@]1(C)OC3=C(C[C@]21C)C(=O)O[C@]3(CC(=O)OC)OC

0 references

found in taxon

Dactylospongia elegans

1 reference

stated in

A new sesquiterpenoid quinone and other related compounds from the Okinawan marine sponge Dactylospongia elegans

Identifiers

InChI

InChI=1S/C23H32O6/c1-14-8-7-9-16-20(14,2)10-11-22(4)21(16,3)12-15-18(28-22)23(27-6,29-19(15)25)13-17(24)26-5/h16H,1,7-13H2,2-6H3/t16-,20-,21+,22-,23-/m0/s1

0 references

InChIKey

YMROJCIRMXQLHK-VLDBVROHSA-N

0 references

1 reference

17 September 2022

inferred from InChIKey

(Q105350704)

methyl 2-[(1R,2S,7R,10S,13S)-13-methoxy-1,7,10-trimethyl-6-methylidene-15-oxo-11,14-dioxatetracyclo[8.7.0.02,7.012,16]heptadec-12(16)-en-13-yl]acetate

Statements

Identifiers

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