(Q105105132)

English

3-[(2S)-2-[(2S,3S,4R,6R,8R)-2-ethyl-4,8-dihydroxy-1,7-dioxaspiro[2.5]octan-6-yl]-4-methylpentanoyl]-2,6-dihydroxy-5-(2-methylpropyl)benzaldehyde

chemical compound

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type of chemical entity

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1 reference

3-[2-(2-Ethyl-4,8-dihydroxy-1,7-dioxaspiro[2.5]octan-6-yl)-4-methylpentanoyl]-2,6-dihydroxy-5-(2-methylpropyl)benzaldehyde

1 reference

based on heuristic

inferred from SMILES

mass

464.241018112 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₅H₃₆O₈

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canonical SMILES

O=CC=1C(O)=C(C=C(C1O)CC(C)C)C(=O)C(CC(C)C)C2OC(O)C3(OC3CC)C(O)C2

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isomeric SMILES

CC[C@@H]1O[C@@]12[C@H](O)C[C@H]([C@H](CC(C)C)C(=O)c1cc(CC(C)C)c(O)c(C=O)c1O)O[C@H]2O

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found in taxon

Streptomyces

1 reference

stated in

Luminacins. A Family of Capillary Tube Formation Inhibitors from Streptomyces sp. I. Taxonomy, Fermentation, Isolation, Physico-chemical Properties and Structure Elucidation.

Identifiers

InChI

InChI=1S/C25H36O8/c1-6-20-25(33-20)19(27)10-18(32-24(25)31)15(8-13(4)5)22(29)16-9-14(7-12(2)3)21(28)17(11-26)23(16)30/h9,11-13,15,18-20,24,27-28,30-31H,6-8,10H2,1-5H3/t15-,18+,19+,20-,24+,25-/m0/s1

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InChIKey

FJDKQPODZMCELQ-GLIVMUMXSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

FJDKQPODZMCELQ-GLIVMUMXSA-N

(Q105105132)

3-[(2S)-2-[(2S,3S,4R,6R,8R)-2-ethyl-4,8-dihydroxy-1,7-dioxaspiro[2.5]octan-6-yl]-4-methylpentanoyl]-2,6-dihydroxy-5-(2-methylpropyl)benzaldehyde

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