(Q105350984)

English

(3aR,4R,6aS,9aR,9bR)-4-hydroxy-9-methyl-3,6-dimethylidene-4,5,6a,7,9a,9b-hexahydro-3aH-azuleno[4,5-b]furan-2-one

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

4-hydroxy-9-methyl-3,6-dimethylidene-4,5,6a,7,9a,9b-hexahydro-3aH-azuleno[4,5-b]furan-2-one

1 reference

based on heuristic

inferred from SMILES

mass

246.125594436 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(3aR,4S,6aR,9aR,9bR)-4-hydroxy-9-methyl-3,6-dimethylidene-4,5,6a,7,9a,9b-hexahydro-3aH-azuleno[4,5-b]furan-2-one

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₅H₁₈O₃

0 references

canonical SMILES

O=C1OC2C(C1=C)C(O)CC(=C)C3CC=C(C)C23

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isomeric SMILES

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

0 references

found in taxon

Eriophyllum staechadifolium

1 reference

stated in

Eriolanolides, eudesmanolides and a rearranged sesquiterpene from Eriophyllum species

Picradeniopsis schaffneri

1 reference

stated in

The monoterpene 9-hydroxythymol from Bahia schaffneri var. aristata

Identifiers

InChI

InChI=1S/C15H18O3/c1-7-4-5-10-8(2)6-11(16)13-9(3)15(17)18-14(13)12(7)10/h4,10-14,16H,2-3,5-6H2,1H3/t10-,11-,12+,13-,14-/m1/s1

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InChIKey

YNKRYYFPKLHACH-RKQHYHRCSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

YNKRYYFPKLHACH-RKQHYHRCSA-N

(Q105350984)

(3aR,4R,6aS,9aR,9bR)-4-hydroxy-9-methyl-3,6-dimethylidene-4,5,6a,7,9a,9b-hexahydro-3aH-azuleno[4,5-b]furan-2-one

Statements

Identifiers

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