(Q105001043)

English

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

chemical compound

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instance of

type of chemical entity

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subclass of

6,6a,7,8,9-pentahydroxy-6,9-dimethyl-3-methylidene-4,5,7,8,9a,9b-hexahydro-3aH-azuleno[4,5-b]furan-2-one

1 reference

based on heuristic

inferred from SMILES

mass

314.136553044 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

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

1 reference

based on heuristic

inferred from InChI

(3aS,9abeta,9balpha)-Decahydro-6beta,6abeta,7alpha,8alpha,9alpha-pentahydroxy-6,9-dimethyl-3-methyleneazuleno[4,5-b]furan-2(3H)-one

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₅H₂₂O₇

0 references

canonical SMILES

O=C1OC2C(C1=C)CCC(O)(C)C3(O)C(O)C(O)C(O)(C)C23

0 references

isomeric SMILES

C=C1C(=O)O[C@@H]2[C@H]1CC[C@@](C)(O)[C@]1(O)[C@@H](O)[C@@H](O)[C@](C)(O)[C@H]21

0 references

found in taxon

Artemisia rutifolia

1 reference

stated in

Sesquiterpene lactones from Artemisia rutifolia

Identifiers

InChI

InChI=1S/C15H22O7/c1-6-7-4-5-13(2,19)15(21)9(8(7)22-12(6)18)14(3,20)10(16)11(15)17/h7-11,16-17,19-21H,1,4-5H2,2-3H3/t7-,8+,9-,10+,11-,13+,14+,15+/m0/s1

0 references

InChIKey

FTHQHWNKKLTVLA-HPGSQUOOSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

FTHQHWNKKLTVLA-HPGSQUOOSA-N

(Q105001043)

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

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Identifiers

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