(Q105349741)

English

(1R,4R,6S,13R,14S)-13-hydroxy-4,9,13-trimethyl-17-methylidene-5,15-dioxatricyclo[12.3.1.0⁴,⁶]octadec-9-en-16-one

chemical compound

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instance of

type of chemical entity

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subclass of

13-hydroxy-4,9,13-trimethyl-17-methylidene-5,15-dioxatricyclo[12.3.1.0⁴,⁶]octadec-9-en-16-one

1 reference

based on heuristic

inferred from SMILES

mass

334.21440943999994 dalton

1 reference

based on heuristic

inferred from isomeric SMILES

stereoisomer of

(1R,4S,6S,9Z,13S,14R)-13-hydroxy-4,9,13-trimethyl-17-methylidene-5,15-dioxatricyclo[12.3.1.04,6]octadec-9-en-16-one

1 reference

based on heuristic

inferred from InChIKey

flexibilide

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(1S,4R,6R,9Z,13R,14S)-13-hydroxy-4,9,13-trimethyl-17-methylidene-5,15-dioxatricyclo[12.3.1.04,6]octadec-9-en-16-one

1 reference

based on heuristic

inferred from InChI

(1R,4R,6R,9E,13S,14S)-13-hydroxy-4,9,13-trimethyl-17-methylidene-5,15-dioxatricyclo[12.3.1.0⁴,⁶]octadec-9-en-16-one

1 reference

based on heuristic

inferred from InChI

(1R,4S,6S,13R,14R)-13-hydroxy-4,9,13-trimethyl-17-methylidene-5,15-dioxatricyclo[12.3.1.04,6]octadec-9-en-16-one

1 reference

based on heuristic

inferred from InChI

(1R,4S,6S,9E,13R,14R)-13-Hydroxy-4,9,13-trimethyl-17-methylidene-5,15-dioxatricyclo[12.3.1.04,6]octadec-9-en-16-one

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₀H₃₀O₄

0 references

canonical SMILES

O=C1OC2CC(C1=C)CCC3(OC3CCC(=CCCC2(O)C)C)C

0 references

isomeric SMILES

C=C1C(=O)O[C@H]2C[C@H]1CC[C@@]1(C)O[C@H]1CCC(C)=CCC[C@@]2(C)O

0 references

1 reference

Identifiers

InChI

InChI=1S/C20H30O4/c1-13-6-5-10-19(3,22)17-12-15(14(2)18(21)23-17)9-11-20(4)16(24-20)8-7-13/h6,15-17,22H,2,5,7-12H2,1,3-4H3/t15-,16+,17+,19-,20-/m1/s1

0 references

InChIKey

YKKJETNBRNDYKN-HDHSKVTNSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

YKKJETNBRNDYKN-HDHSKVTNSA-N

(Q105349741)

(1R,4R,6S,13R,14S)-13-hydroxy-4,9,13-trimethyl-17-methylidene-5,15-dioxatricyclo[12.3.1.0⁴,⁶]octadec-9-en-16-one

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