(Q105253537)

English

(1S,5R,5aR,8aS,9R)-5-ethoxy-1,9-dihydroxy-5,7,7-trimethyl-4,5a,6,8,8a,9-hexahydro-1H-azuleno[5,6-c]furan-3-one

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

5-ethoxy-1,9-dihydroxy-5,7,7-trimethyl-4,5a,6,8,8a,9-hexahydro-1H-azuleno[5,6-c]furan-3-one

1 reference

based on heuristic

inferred from SMILES

mass

310.178023932 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(1S,5S,5aS,8aR,9S)-5-ethoxy-1,9-dihydroxy-5,7,7-trimethyl-4,5a,6,8,8a,9-hexahydro-1H-azuleno[5,6-c]furan-3-one

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₇H₂₆O₅

0 references

canonical SMILES

O=C1OC(O)C2=C1CC(OCC)(C)C3CC(C)(C)CC3C2O

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isomeric SMILES

CCO[C@]1(C)CC2=C([C@@H](O)OC2=O)[C@H](O)[C@H]2CC(C)(C)C[C@H]21

0 references

found in taxon

Lactarius vellereus

1 reference

stated in

1,2-Dehydrolactarolide A, a New Plant Growth Regulatory Lactarane Sesquiterpene fromLactarius vellereus

Lactifluus vellereus

1 reference

stated in

1,2-Dehydrolactarolide A, a New Plant Growth Regulatory Lactarane Sesquiterpene fromLactarius vellereus

Identifiers

InChI

InChI=1S/C17H26O5/c1-5-21-17(4)7-10-12(15(20)22-14(10)19)13(18)9-6-16(2,3)8-11(9)17/h9,11,13,15,18,20H,5-8H2,1-4H3/t9-,11+,13+,15-,17+/m0/s1

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InChIKey

SIAZGPIXCCBVST-RRPSGLLQSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

SIAZGPIXCCBVST-RRPSGLLQSA-N

(Q105253537)

(1S,5R,5aR,8aS,9R)-5-ethoxy-1,9-dihydroxy-5,7,7-trimethyl-4,5a,6,8,8a,9-hexahydro-1H-azuleno[5,6-c]furan-3-one

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Identifiers

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