(Q105152330)

English

(2S)-1-[3-acetyl-2,4-dihydroxy-5-(2-methylpropyl)phenyl]-2-[(2S,3S,4R,6R,8R)-2-ethyl-4,8-dihydroxy-1,7-dioxaspiro[2.5]octan-6-yl]pentan-1-one

chemical compound

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type of chemical entity

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subclass of

1-[3-acetyl-2,4-dihydroxy-5-(2-methylpropyl)phenyl]-2-[(2S,3R,4R,8S)-2-ethyl-4,8-dihydroxy-1,5-dioxaspiro[2.5]octan-6-yl]pentan-1-one

1 reference

1 reference

1-[3-Acetyl-2,4-dihydroxy-5-(2-methylpropyl)phenyl]-2-(2-ethyl-4,8-dihydroxy-1,7-dioxaspiro[2.5]octan-6-yl)pentan-1-one

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

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isomeric SMILES

CCC[C@H](C(=O)c1cc(CC(C)C)c(O)c(C(C)=O)c1O)[C@H]1C[C@@H](O)[C@@]2(O[C@H]2CC)[C@H](O)O1

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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/c1-6-8-15(17-11-18(27)25(24(31)32-17)19(7-2)33-25)22(29)16-10-14(9-12(3)4)21(28)20(13(5)26)23(16)30/h10,12,15,17-19,24,27-28,30-31H,6-9,11H2,1-5H3/t15-,17+,18+,19-,24+,25-/m0/s1

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InChIKey

LIQGTIOZHQFVPU-IMMZBLMOSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

LIQGTIOZHQFVPU-IMMZBLMOSA-N

(Q105152330)

(2S)-1-[3-acetyl-2,4-dihydroxy-5-(2-methylpropyl)phenyl]-2-[(2S,3S,4R,6R,8R)-2-ethyl-4,8-dihydroxy-1,7-dioxaspiro[2.5]octan-6-yl]pentan-1-one

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