(Q104197979)

English

5-[[6-[(5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl)methyl]-2,5-dioxo-7-oxabicyclo[4.1.0]hept-3-en-3-yl]methoxy]-3-hydroxy-3-methyl-5-oxopentanoic acid

group of stereoisomers with the chemical formula C₂₈H₃₈O₈

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instance of

group of stereoisomers

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subclass of

chemical compound

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mass

502.256668176 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₈H₃₈O₈

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canonical SMILES

O=C(O)CC(O)(C)CC(=O)OCC1=CC(=O)C2(OC2C1=O)CC3C(=C)CCC4C(C)(C)CCCC34C

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found in taxon

Penicillium crustaceum

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stated in

Immunomodulatory constituents from an Ascomycete, Eupenicillium crustaceum, and revised absolute structure of macrophorin D.

Identifiers

InChI

InChI=1S/C28H38O8/c1-16-7-8-19-25(2,3)9-6-10-27(19,5)18(16)12-28-20(29)11-17(23(33)24(28)36-28)15-35-22(32)14-26(4,34)13-21(30)31/h11,18-19,24,34H,1,6-10,12-15H2,2-5H3,(H,30,31)

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InChIKey

TZHODXJMZGQSQM-UHFFFAOYSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

TZHODXJMZGQSQM-UHFFFAOYSA-N

(Q104197979)

5-[[6-[(5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl)methyl]-2,5-dioxo-7-oxabicyclo[4.1.0]hept-3-en-3-yl]methoxy]-3-hydroxy-3-methyl-5-oxopentanoic acid

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Identifiers

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