(Q105028901)

English

(1S,2S,10S,12R,14R,16R,18S)-16-(furan-3-yl)-18-methyl-8,13,15-trioxapentacyclo[10.5.1.01,14.02,10.06,10]octadeca-3,5-dien-7-one

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

16-(Furan-3-yl)-18-methyl-8,13,15-trioxapentacyclo[10.5.1.01,14.02,10.06,10]octadeca-3,5-dien-7-one

1 reference

based on heuristic

inferred from SMILES

(1S,2R,10S,14S,16R,18S)-16-(furan-3-yl)-18-methyl-8,13,15-trioxapentacyclo[10.5.1.0¹,¹⁴.0²,¹⁰.0⁶,¹⁰]octadeca-3,5-dien-7-one

1 reference

based on heuristic

inferred from SMILES

mass

340.13107374 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(1R,2R,10S,12S,14S,16S,18R)-16-(furan-3-yl)-18-methyl-8,13,15-trioxapentacyclo[10.5.1.01,14.02,10.06,10]octadeca-3,5-dien-7-one

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(1S,2R,10S,12R,14R,16R,18S)-16-(furan-3-yl)-18-methyl-8,13,15-trioxapentacyclo[10.5.1.01,14.02,10.06,10]octadeca-3,5-dien-7-one

1 reference

based on heuristic

inferred from InChI

(1R,2R,10S,12S,14R,16R,18S)-16-(furan-3-yl)-18-methyl-8,13,15-trioxapentacyclo[10.5.1.01,14.02,10.06,10]octadeca-3,5-dien-7-one

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₀H₂₀O₅

0 references

canonical SMILES

O=C1OCC23C1=CC=CC2C45CC(OC5OC(C3)C4C)C6=COC=C6

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isomeric SMILES

C[C@@H]1[C@H]2C[C@@]34COC(=O)C3=CC=C[C@@H]4[C@@]13C[C@H](c1ccoc1)O[C@H]3O2

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found in taxon

Salvia farinacea

1 reference

stated in

Salvifarin and salvifaricin, neo-clerodane diterpenoids from salvia farinacea

Identifiers

InChI

InChI=1S/C20H20O5/c1-11-14-7-19-10-23-17(21)13(19)3-2-4-16(19)20(11)8-15(25-18(20)24-14)12-5-6-22-9-12/h2-6,9,11,14-16,18H,7-8,10H2,1H3/t11-,14-,15-,16+,18-,19-,20-/m1/s1

0 references

InChIKey

HIKUAKUTPBLJKQ-VSLSTRFISA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

HIKUAKUTPBLJKQ-VSLSTRFISA-N

(Q105028901)

(1S,2S,10S,12R,14R,16R,18S)-16-(furan-3-yl)-18-methyl-8,13,15-trioxapentacyclo[10.5.1.01,14.02,10.06,10]octadeca-3,5-dien-7-one

Statements

Identifiers

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