(Q104944079)

English

(3aS,5R,5aS,6S,8S,8aS,9aR)-6,8-dihydroxy-5,8a-dimethyl-1-methylidene-4,5,5a,6,7,8,9,9a-octahydro-3aH-azuleno[6,5-b]furan-2-one

chemical compound

In more languages

Statements

type of chemical entity

0 references

Azuleno(6,5-b)furan-2(3H)-one, decahydro-5,7-dihydroxy-4a,8-dimethyl-3-methylene-, (3aR,4aS,5R,7S,7aS,8R,9aS)-

1 reference

based on heuristic

inferred from SMILES

(3aR,8aS,9aR)-6,8-dihydroxy-5,8a-dimethyl-1-methylidene-4,5,5a,6,7,8,9,9a-octahydro-3aH-azuleno[6,5-b]furan-2-one

1 reference

based on heuristic

inferred from SMILES

266.151809184 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(3aR,5R,5aS,6S,8S,8aS,9aR)-6,8-dihydroxy-5,8a-dimethyl-1-methylidene-4,5,5a,6,7,8,9,9a-octahydro-3aH-azuleno[6,5-b]furan-2-one

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

4-Epipulchellin

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(3aalpha,7aalpha,9abeta)-3-Methylene-4abeta,8beta-dimethyl-5beta,7alpha-dihydroxydodecahydroazuleno[6,5-b]furan-2-one

1 reference

based on heuristic

inferred from InChI

1 reference

based on heuristic

inferred from InChI

(3aR,5S,5aR,6S,8R,8aS,9aS)-6,8-dihydroxy-5,8a-dimethyl-1-methylidene-4,5,5a,6,7,8,9,9a-octahydro-3aH-azuleno[6,5-b]furan-2-one

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₅H₂₂O₄

0 references

canonical SMILES

O=C1OC2CC(C)C3C(O)CC(O)C3(C)CC2C1=C

0 references

isomeric SMILES

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

0 references

Gaillardia pulchella

2 references

Isolation and Structure of New Pseudoguaianolides, 4-Epipulchellin and 4-Epineopulchellin from Gaillardia Pulchella

Structure-Activity Relationships of Pseudoguaianolides Isolated from Gaillardia pulchella and Their Derivatives

Identifiers

InChI=1S/C15H22O4/c1-7-4-11-9(8(2)14(18)19-11)6-15(3)12(17)5-10(16)13(7)15/h7,9-13,16-17H,2,4-6H2,1,3H3/t7-,9-,10+,11+,12+,13-,15-/m1/s1

0 references

BPUNWVGCTMEMKQ-IQXKZXBGSA-N

0 references

1 reference

17 September 2022

based on heuristic

inferred from InChIKey

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