(Q105233794)

English

3-methyl-6,9-dimethylidene-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3a,4,5,6a,7,8,9a,9b-octahydro-3H-azuleno[4,5-b]furan-2-one

group of stereoisomers with the chemical formula C₂₁H₃₀O₈

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Statements

instance of

group of stereoisomers

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subclass of

guaiane sesquiterpenoid

1 reference

inferred from

guaiane sesquiterpenoid

mass

410.1940679199998 dalton

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₁H₃₀O₈

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canonical SMILES

O=C1OC2C3C(=C)CCC3C(=C)C(OC4OC(CO)C(O)C(O)C4O)CC2C1C

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found in taxon

Notoseris psilolepis

1 reference

stated in

Chemical Constituents of Marchantiophyta

Identifiers

InChI

InChI=1S/C21H30O8/c1-8-4-5-11-9(2)13(6-12-10(3)20(26)29-19(12)15(8)11)27-21-18(25)17(24)16(23)14(7-22)28-21/h10-19,21-25H,1-2,4-7H2,3H3

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InChIKey

RCMFOCNCKTYXQN-UHFFFAOYSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

RCMFOCNCKTYXQN-UHFFFAOYSA-N

1 reference

Human Metabolome Database ID

HMDB0040713

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

RCMFOCNCKTYXQN-UHFFFAOYSA-N

(Q105233794)

3-methyl-6,9-dimethylidene-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3a,4,5,6a,7,8,9a,9b-octahydro-3H-azuleno[4,5-b]furan-2-one

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