(Q105182197)

English

(3aR,4R,5R,11aS)-4,5-dihydroxy-6,10-dimethyl-3-methylidene-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-2-one

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

4,5-Dihydroxy-6,10-dimethyl-3-methylidene-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-2-one

1 reference

based on heuristic

inferred from SMILES

mass

264.13615912 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(3aR,4R,5R,6Z,10E,11aS)-4,5-dihydroxy-6,10-dimethyl-3-methylidene-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-2-one

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(3aS,4R,5R,6E,10E,11aR)-4,5-dihydroxy-6,10-dimethyl-3-methylidene-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-2-one

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₅H₂₀O₄

0 references

canonical SMILES

O=C1OC2C=C(C)CCC=C(C)C(O)C(O)C2C1=C

0 references

isomeric SMILES

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

0 references

found in taxon

Montanoa hibiscifolia

1 reference

stated in

Sesquiterpene lactones from Montanoa hibiscifolia that inhibit the transcription factor NF-kappa B.

Identifiers

InChI

InChI=1S/C15H20O4/c1-8-5-4-6-9(2)13(16)14(17)12-10(3)15(18)19-11(12)7-8/h6-7,11-14,16-17H,3-5H2,1-2H3/t11-,12-,13+,14+/m0/s1

0 references

InChIKey

NNLKMZXSOLUXBB-IGQOVBAYSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

NNLKMZXSOLUXBB-IGQOVBAYSA-N

(Q105182197)

(3aR,4R,5R,11aS)-4,5-dihydroxy-6,10-dimethyl-3-methylidene-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-2-one

Statements

Identifiers

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