(Q105173884)

English

(3aR,5Z,10E,14E,15aR)-6,10,14-trimethyl-3-methylidene-4,8,9,12,13,15a-hexahydro-3aH-cyclotetradeca[b]furan-2,7-dione

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

cembrane

0 references

mass

314.188194692 dalton

1 reference

2 references

inferred from InChIKey

based on heuristic

inferred from InChI

(3aR,15aR)-6,10,14-trimethyl-3-methylidene-4,8,9,12,13,15a-hexahydro-3aH-cyclotetradeca[b]furan-2,7-dione

1 reference

based on heuristic

inferred from InChI

(3aS,5Z,10E,15aS)-6,10,14-trimethyl-3-methylidene-4,8,9,12,13,15a-hexahydro-3aH-cyclotetradeca[b]furan-2,7-dione

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₀H₂₆O₃

0 references

canonical SMILES

O=C1OC2C=C(C)CCC=C(C)CCC(=O)C(=CCC2C1=C)C

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isomeric SMILES

C=C1C(=O)O[C@@H]2/C=C(\C)CC/C=C(\C)CCC(=O)/C(C)=C\C[C@H]12

0 references

found in taxon

Sarcophyton crassocaule

1 reference

stated in

Crassocolides N-P, three cembranoids from the Formosan soft coral Sarcophyton crassocaule

Identifiers

InChI

InChI=1S/C20H26O3/c1-13-6-5-7-14(2)12-19-17(16(4)20(22)23-19)10-9-15(3)18(21)11-8-13/h6,9,12,17,19H,4-5,7-8,10-11H2,1-3H3/b13-6+,14-12+,15-9-/t17-,19-/m1/s1

0 references

InChIKey

MWYQRKSBBTVTOQ-CCXUCLJPSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

MWYQRKSBBTVTOQ-CCXUCLJPSA-N

(Q105173884)

(3aR,5Z,10E,14E,15aR)-6,10,14-trimethyl-3-methylidene-4,8,9,12,13,15a-hexahydro-3aH-cyclotetradeca[b]furan-2,7-dione

Statements

Identifiers

Sitelinks

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