(Q105137670)

English

3abeta,4,5,5a,6,7,8,9,9abeta,9balpha-Decahydro-3beta,5aalpha,9alpha-trimethyl-6alpha,9-dihydroxynaphtho[1,2-b]furan-2(3H)-one

chemical compound

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instance of

type of chemical entity

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subclass of

(3S)-3a,4,5,5a,6,7,8,9,9abeta,9balpha-Decahydro-6alpha,9-dihydroxy-3,5aalpha,9alpha-trimethylnaphtho[1,2-b]furan-2(3H)-one

1 reference

based on heuristic

inferred from SMILES

6,9-dihydroxy-3,5a,9-trimethyl-3a,4,5,6,7,8,9a,9b-octahydro-3H-benzo[g][1]benzofuran-2-one

1 reference

based on heuristic

inferred from SMILES

mass

268.167459248 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(3S,3aS,5aR,6R,9S,9aS,9bS)-6,9-dihydroxy-3,5a,9-trimethyl-3a,4,5,6,7,8,9a,9b-octahydro-3H-benzo[g][1]benzofuran-2-one

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(3R)-3abeta,4,5,5a,6,7,8,9,9abeta,9balpha-Decahydro-3alpha,5aalpha,9-trimethyl-6alpha,9alpha-dihydroxynaphtho[1,2-b]furan-2(3H)-one

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(3S)-3abeta,4,5,5a,6,7,8,9,9abeta,9balpha-Decahydro-3beta,5aalpha,9-trimethyl-6beta,9beta-dihydroxynaphtho[1,2-b]furan-2(3H)-one

1 reference

based on heuristic

inferred from InChI

(3S,3aR,5aR,6R,9R,9aS,9bS)-6,9-dihydroxy-3,5a,9-trimethyl-3a,4,5,6,7,8,9a,9b-octahydro-3H-benzo[g][1]benzofuran-2-one

1 reference

based on heuristic

inferred from InChI

(3R)-3abeta,4,5,5a,6,7,8,9,9abeta,9balpha-Decahydro-3alpha,5aalpha,9-trimethyl-6alpha,9beta-dihydroxynaphtho[1,2-b]furan-2(3H)-one

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₅H₂₄O₄

0 references

canonical SMILES

O=C1OC2C(CCC3(C)C(O)CCC(O)(C)C23)C1C

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isomeric SMILES

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

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found in taxon

Tanacetum vulgare

1 reference

stated in

On terpenes. CCXXIX. Structure of sesquiterpenic lactones from Tanacetum vulgare L.

Artemisia cana

1 reference

stated in

Minor eudesmanolides from Artemisia canariensis

Artemisia canariensis

1 reference

stated in

Minor eudesmanolides from Artemisia canariensis

Artemisia thuscula

1 reference

stated in

Minor eudesmanolides from Artemisia canariensis

Magnolia kachirachirai

1 reference

stated in

Cytotoxic sesquiterpenes from Magnolia kachirachirai

Artemisia herba-alba

1 reference

stated in

Eudesmanolides and other constituents from Artemisia herba-alba

Dolomiaea costus

1 reference

stated in

Cytotoxic sesquiterpene lactones from the root of Saussurea lappa

Identifiers

InChI

InChI=1S/C15H24O4/c1-8-9-4-6-14(2)10(16)5-7-15(3,18)12(14)11(9)19-13(8)17/h8-12,16,18H,4-7H2,1-3H3/t8-,9-,10+,11-,12+,14-,15+/m0/s1

0 references

InChIKey

JZWIOLGEFWVOLI-PDIQHLCYSA-N

0 references

1 reference

17 September 2022

inferred from InChIKey

1 reference

(Q105137670)

3abeta,4,5,5a,6,7,8,9,9abeta,9balpha-Decahydro-3beta,5aalpha,9alpha-trimethyl-6alpha,9-dihydroxynaphtho[1,2-b]furan-2(3H)-one

Statements

Identifiers

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