(Q105132618)

English

(6aR,7S,8R,10aS)-7,8-dimethyl-7-[2-(5-oxo-2H-furan-3-yl)ethyl]-5,6,6a,8,9,10-hexahydro-1H-benzo[d][2]benzofuran-3-one

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

4-(2-{7,8-dimethyl-3-oxo-1H,5H,6H,6aH,8H,9H,10H-naphtho[4,4a-c]furan-7-yl}ethyl)-5H-furan-2-one

1 reference

1 reference

330.183109312 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

6-Desoxysolidagolacton-IV-18,19-olid

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(6aS,7R,8S,10aS)-7,8-dimethyl-7-[2-(5-oxo-2H-furan-3-yl)ethyl]-5,6,6a,8,9,10-hexahydro-1H-benzo[d][2]benzofuran-3-one

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₀H₂₆O₄

0 references

canonical SMILES

O=C1OCC(=C1)CCC2(C)C(C)CCC34C(=CCCC32)C(=O)OC4

0 references

isomeric SMILES

C[C@@H]1CC[C@@]23COC(=O)C2=CCC[C@@H]3[C@@]1(C)CCC1=CC(=O)OC1

0 references

found in taxon

Baccharis salicifolia

1 reference

stated in

13- EPI-NEOCLERODANES FROM BACCHARIS MARGINALIS

Baccharis rufidula

1 reference

stated in

Neo-clerodane type diterpenes from Baccharis trinervis

Baccharis trinervis

1 reference

stated in

Neo-clerodane type diterpenes from Baccharis trinervis

Identifiers

InChI

InChI=1S/C20H26O4/c1-13-6-9-20-12-24-18(22)15(20)4-3-5-16(20)19(13,2)8-7-14-10-17(21)23-11-14/h4,10,13,16H,3,5-9,11-12H2,1-2H3/t13-,16-,19+,20-/m1/s1

0 references

InChIKey

JPADNOYXVVHBCB-LONLNUGOSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

JPADNOYXVVHBCB-LONLNUGOSA-N

(Q105132618)

(6aR,7S,8R,10aS)-7,8-dimethyl-7-[2-(5-oxo-2H-furan-3-yl)ethyl]-5,6,6a,8,9,10-hexahydro-1H-benzo[d][2]benzofuran-3-one

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Identifiers

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