(Q104909516)

English

[(1R,3S,4R,7R,8R,12R)-8-hydroxy-4,8,12-trimethyl-15-methylidene-11,14-dioxo-13,18-dioxatricyclo[10.3.2.14,7]octadecan-3-yl] acetate

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

(8-Hydroxy-4,8,12-trimethyl-15-methylidene-11,14-dioxo-13,18-dioxatricyclo[10.3.2.14,7]octadecan-3-yl) acetate

1 reference

based on heuristic

inferred from SMILES

mass

408.214803364 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(4R,6S,7R,10S,11R,15R)-3-Methylene-4,15-ethano-6-acetoxy-7,11,15-trimethyl-7,10-epoxy-11-hydroxy-1-oxacyclopentadecane-2,14-dione

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₂H₃₂O₇

0 references

canonical SMILES

O=C1OC2(C(=O)CCC(O)(C)C3OC(C)(CC3)C(OC(=O)C)CC(C1=C)CC2)C

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isomeric SMILES

C=C1C(=O)O[C@]2(C)CC[C@@H]1C[C@H](OC(C)=O)[C@@]1(C)CC[C@@H](O1)[C@](C)(O)CCC2=O

0 references

found in taxon

Sinularia querciformis

1 reference

stated in

Anti-inflammatory cembranoids from the soft corals Sinularia querciformis and Sinularia granosa

Identifiers

InChI

InChI=1S/C22H32O7/c1-13-15-6-10-21(4,29-19(13)25)16(24)7-9-20(3,26)17-8-11-22(5,28-17)18(12-15)27-14(2)23/h15,17-18,26H,1,6-12H2,2-5H3/t15-,17-,18+,20-,21-,22-/m1/s1

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InChIKey

ADEVBUKPYQGFGW-DWADQXAYSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

ADEVBUKPYQGFGW-DWADQXAYSA-N

(Q104909516)

[(1R,3S,4R,7R,8R,12R)-8-hydroxy-4,8,12-trimethyl-15-methylidene-11,14-dioxo-13,18-dioxatricyclo[10.3.2.14,7]octadecan-3-yl] acetate

Statements

Identifiers

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