(Q105188714)

English

(4aS,8R,8aS)-8-hydroxy-3,8a-dimethyl-5-methylene-4a,5,6,7,8,8a-hexahydronaphtho[2,3-b]furan-2(4H)-one

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

8-hydroxy-3,8a-dimethyl-5-methylidene-4a,6,7,8-tetrahydro-4H-benzo[f][1]benzofuran-2-one

1 reference

based on heuristic

inferred from SMILES

mass

246.125594436 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(4aS,8R,8aR)-8-hydroxy-3,8a-dimethyl-5-methylidene-4a,6,7,8-tetrahydro-4H-benzo[f][1]benzofuran-2-one

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₁₅H₁₈O₃

0 references

canonical SMILES

O=C1OC2=CC3(C)C(O)CCC(=C)C3CC2=C1C

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isomeric SMILES

C=C1CC[C@@H](O)[C@]2(C)C=C3OC(=O)C(C)=C3C[C@@H]12

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found in taxon

Licaria triandra

1 reference

stated in

Cytotoxic constituents of the stem bark of Neolitsea acuminatissima

Neolitsea acuminatissima

1 reference

stated in

Cytotoxic constituents of the stem bark of Neolitsea acuminatissima

Identifiers

InChI

InChI=1S/C15H18O3/c1-8-4-5-13(16)15(3)7-12-10(6-11(8)15)9(2)14(17)18-12/h7,11,13,16H,1,4-6H2,2-3H3/t11-,13+,15+/m0/s1

0 references

InChIKey

OAKMFBHDBVZTBA-NJZAAPMLSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

OAKMFBHDBVZTBA-NJZAAPMLSA-N

1 reference

NMRShiftDB structure ID

20028255

1 reference

matched by identifier from

InChIKey

OAKMFBHDBVZTBA-NJZAAPMLSA-N

(Q105188714)

(4aS,8R,8aS)-8-hydroxy-3,8a-dimethyl-5-methylene-4a,5,6,7,8,8a-hexahydronaphtho[2,3-b]furan-2(4H)-one

Statements

Identifiers

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