(Q105205518)

English

(3R,3aS,6S,6aR,9aR,9bS)-6-hydroxy-6-(hydroxymethyl)-3-methyl-9-methylidene-3a,4,5,6a,7,8,9a,9b-octahydro-3H-azuleno[4,5-b]furan-2-one

chemical compound

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instance of

type of chemical entity

0 references

subclass of

6-hydroxy-6-(hydroxymethyl)-3-methyl-9-methylidene-3a,4,5,6a,7,8,9a,9b-octahydro-3H-azuleno[4,5-b]furan-2-one

1 reference

based on heuristic

inferred from SMILES

mass

266.151809184 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(3S,3aS,6R,6aR,9aR,9bS)-6-hydroxy-6-(hydroxymethyl)-3-methyl-9-methylidene-3a,4,5,6a,7,8,9a,9b-octahydro-3H-azuleno[4,5-b]furan-2-one

1 reference

based on heuristic

inferred from InChIKey

(3S,3aS,6S,6aR,9aR,9bS)-6-hydroxy-6-(hydroxymethyl)-3-methyl-9-methylidene-3a,4,5,6a,7,8,9a,9b-octahydro-3H-azuleno[4,5-b]furan-2-one

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₁₅H₂₂O₄

0 references

canonical SMILES

O=C1OC2C3C(=C)CCC3C(O)(CO)CCC2C1C

0 references

isomeric SMILES

C=C1CC[C@@H]2[C@H]1[C@H]1OC(=O)[C@H](C)[C@@H]1CC[C@@]2(O)CO

0 references

found in taxon

Dolomiaea souliei

1 reference

stated in

Sesquiterpene lactones from Vladimiria souliei

Identifiers

InChI

InChI=1S/C15H22O4/c1-8-3-4-11-12(8)13-10(9(2)14(17)19-13)5-6-15(11,18)7-16/h9-13,16,18H,1,3-7H2,2H3/t9-,10+,11-,12+,13+,15-/m1/s1

0 references

InChIKey

PBXKFMXJVNEHCU-YZDFOLFKSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

PBXKFMXJVNEHCU-YZDFOLFKSA-N

(Q105205518)

(3R,3aS,6S,6aR,9aR,9bS)-6-hydroxy-6-(hydroxymethyl)-3-methyl-9-methylidene-3a,4,5,6a,7,8,9a,9b-octahydro-3H-azuleno[4,5-b]furan-2-one

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Identifiers

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