(Q104991300)

English

(3aR,4aS,9bbeta)-Dodecahydro-3,7-dioxo-6abeta,9aalpha-dimethyl-1H-cyclopenta[a]cyclopropa[e]naphthalene-3aalpha-acetic acid

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

2-(4,8-Dimethyl-5,12-dioxo-13-tetracyclo[7.5.0.01,13.04,8]tetradecanyl)acetic acid

1 reference

based on heuristic

inferred from SMILES

mass

304.167459248 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₈H₂₄O₄

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canonical SMILES

O=C(O)CC12C(=O)CCC3C4(C)CCC(=O)C4(C)CCC32C1

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isomeric SMILES

C[C@]12CC[C@@]34C[C@]3(CC(=O)O)C(=O)CC[C@H]4[C@]1(C)CCC2=O

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found in taxon

Aglaia rubiginosa

1 reference

stated in

Phytochemical investigation of Aglaia rubiginosa

Identifiers

InChI

InChI=1S/C18H24O4/c1-15-6-5-12(19)16(15,2)7-8-17-10-18(17,9-14(21)22)13(20)4-3-11(15)17/h11H,3-10H2,1-2H3,(H,21,22)/t11-,15-,16+,17-,18+/m0/s1

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InChIKey

DYBBZRYFSCINDM-OQGBHLKSSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

DYBBZRYFSCINDM-OQGBHLKSSA-N

1 reference

(Q104991300)

(3aR,4aS,9bbeta)-Dodecahydro-3,7-dioxo-6abeta,9aalpha-dimethyl-1H-cyclopenta[a]cyclopropa[e]naphthalene-3aalpha-acetic acid

Statements

Identifiers

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