(Q105303728)

English

(3aR,4S,5aR,6S,9aS,9bR)-4,6-dihydroxy-5a,9-dimethyl-3-methylidene-4,5,6,7,9a,9b-hexahydro-3aH-benzo[g][1]benzofuran-2-one

chemical compound

In more languages

Statements

type of chemical entity

0 references

4,6-Dihydroxy-5a,9-dimethyl-3-methylidene-4,5,6,7,9a,9b-hexahydro-3aH-benzo[g][1]benzofuran-2-one

1 reference

based on heuristic

inferred from SMILES

264.13615912 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(3aR,4S,5aR,6R,9aS,9bR)-4,6-dihydroxy-5a,9-dimethyl-3-methylidene-4,5,6,7,9a,9b-hexahydro-3aH-benzo[g][1]benzofuran-2-one

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(3aR,4R,5aS,6S,9aR,9bS)-4,6-dihydroxy-5a,9-dimethyl-3-methylidene-4,5,6,7,9a,9b-hexahydro-3aH-benzo[g][1]benzofuran-2-one

1 reference

based on heuristic

inferred from InChIKey

(3aR,4R,5aR,6R,9aS,9bR)-4,6-dihydroxy-5a,9-dimethyl-3-methylidene-4,5,6,7,9a,9b-hexahydro-3aH-benzo[g][1]benzofuran-2-one

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₁₅H₂₀O₄

0 references

canonical SMILES

O=C1OC2C(C1=C)C(O)CC3(C)C(O)CC=C(C)C23

0 references

isomeric SMILES

C=C1C(=O)O[C@@H]2[C@H]3C(C)=CC[C@H](O)[C@]3(C)C[C@H](O)[C@@H]12

0 references

Anthemis carpatica

1 reference

Sesquiterpene lactones as chemotaxonomic markers in genus Anthemis

Identifiers

InChI=1S/C15H20O4/c1-7-4-5-10(17)15(3)6-9(16)11-8(2)14(18)19-13(11)12(7)15/h4,9-13,16-17H,2,5-6H2,1,3H3/t9-,10-,11+,12+,13-,15-/m0/s1

0 references

WFAAGXPGVHXCKA-DMLGPZFASA-N

0 references

1 reference

17 September 2022

based on heuristic

inferred from InChIKey

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