(Q104999123)

English

(3S,3aR,4aS,7S,8aR,9aR)-7-hydroxy-3,8a-dimethyl-5-methylidene-octahydro-3H-naphtho[2,3-b]furan-2-one

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

7-hydroxy-3,8a-dimethyl-5-methylidene-3a,4,4a,6,7,8,9,9a-octahydro-3H-benzo[f][1]benzofuran-2-one

1 reference

based on heuristic

inferred from SMILES

mass

250.156894564 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(3R,3aR,4aS,7S,8aR,9aR)-7-hydroxy-3,8a-dimethyl-5-methylidene-3a,4,4a,6,7,8,9,9a-octahydro-3H-benzo[f][1]benzofuran-2-one

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₁₅H₂₂O₃

0 references

canonical SMILES

O=C1OC2CC3(C)CC(O)CC(=C)C3CC2C1C

0 references

isomeric SMILES

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

0 references

found in taxon

Carpesium macrocephalum

2 references

stated in

Sesquiterpene lactone glycosides, eudesmanolides, and other constituents from Carpesium macrocephalum

stated in

Sesquiterpene Lactones and other Constituents from the Aerial Parts of Carpesium macrocephalum

Dittrichia graveolens

1 reference

stated in

Cytotoxic and antibacterial sesquiterpenes from Inula graveolens

Identifiers

InChI

InChI=1S/C15H22O3/c1-8-4-10(16)6-15(3)7-13-11(5-12(8)15)9(2)14(17)18-13/h9-13,16H,1,4-7H2,2-3H3/t9-,10-,11+,12-,13+,15+/m0/s1

0 references

InChIKey

FPEGOJNBPHXMRU-GGZSWOCBSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

FPEGOJNBPHXMRU-GGZSWOCBSA-N

1 reference

(Q104999123)

(3S,3aR,4aS,7S,8aR,9aR)-7-hydroxy-3,8a-dimethyl-5-methylidene-octahydro-3H-naphtho[2,3-b]furan-2-one

Statements

Identifiers

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