(Q105163008)

English

[9,10,20-Triacetyloxy-7-(furan-3-yl)-1,8,12,17,17-pentamethyl-5,15-dioxo-3,6,16-trioxapentacyclo[9.9.0.02,4.02,8.012,18]icos-13-en-19-yl] acetate

group of stereoisomers with the chemical formula C₃₄H₄₀O₁₄

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Statements

instance of

group of stereoisomers

0 references

1 reference

672.24180596 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₄H₄₀O₁₄

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canonical SMILES

O=C1OC(C)(C)C2C(OC(=O)C)C(OC(=O)C)C3(C)C(C(OC(=O)C)C(OC(=O)C)C4(C)C(OC(=O)C5OC543)C6=COC=C6)C2(C=C1)C

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found in taxon

Toona ciliata

1 reference

stated in

Triterpenoids from the leaves of Toona ciliata

Harrisonia perforata

1 reference

stated in

Chemical constituents from fruits of Harrisonia perforata

Identifiers

InChI

InChI=1S/C34H40O14/c1-15(35)42-21-23-30(5,6)47-20(39)10-12-31(23,7)24-22(43-16(2)36)27(45-18(4)38)33(9)25(19-11-13-41-14-19)46-29(40)28-34(33,48-28)32(24,8)26(21)44-17(3)37/h10-14,21-28H,1-9H3

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InChIKey

MFTJTVBEGOKYTQ-UHFFFAOYSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

MFTJTVBEGOKYTQ-UHFFFAOYSA-N

Human Metabolome Database ID

HMDB0256338

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

MFTJTVBEGOKYTQ-UHFFFAOYSA-N

(Q105163008)

[9,10,20-Triacetyloxy-7-(furan-3-yl)-1,8,12,17,17-pentamethyl-5,15-dioxo-3,6,16-trioxapentacyclo[9.9.0.02,4.02,8.012,18]icos-13-en-19-yl] acetate

Statements

Identifiers

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