(Q105128167)

English

(2R,3S,4S,5R,6R)-3,5-dihydroxy-2-{[(15R)-16-[(5S)-2-hydroxy-1,5-dimethyl-4-oxo-5H-pyrrol-3-yl]-15-methyl-16-oxohexadecyl]oxy}-6-(hydroxymethyl)oxan-4-yl acetate

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

pyrrolidine alkaloid

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mass

599.366946896 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₁H₅₃NO₁₀

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canonical SMILES

O=C(OC1C(O)C(OCCCCCCCCCCCCCCC(C(=O)C=2C(=O)C(N(C2O)C)C)C)OC(CO)C1O)C

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isomeric SMILES

CC(=O)O[C@@H]1[C@H](O)[C@H](OCCCCCCCCCCCCCC[C@@H](C)C(=O)C2=C(O)N(C)[C@@H](C)C2=O)O[C@H](CO)[C@H]1O

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found in taxon

Epicoccum

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stated in

Epicoccamides B–D, Glycosylated Tetramic Acid Derivatives from anEpicoccumsp. Associated with the Tree FungusPholiota squarrosa

Identifiers

InChI

InChI=1S/C31H53NO10/c1-20(25(35)24-26(36)21(2)32(4)30(24)39)17-15-13-11-9-7-5-6-8-10-12-14-16-18-40-31-28(38)29(41-22(3)34)27(37)23(19-33)42-31/h20-21,23,27-29,31,33,37-39H,5-19H2,1-4H3/t20-,21+,23-,27-,28+,29+,31-/m1/s1

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InChIKey

JHQOGDPWNIOQFH-RCECMIMJSA-N

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(Q105128167)

(2R,3S,4S,5R,6R)-3,5-dihydroxy-2-{[(15R)-16-[(5S)-2-hydroxy-1,5-dimethyl-4-oxo-5H-pyrrol-3-yl]-15-methyl-16-oxohexadecyl]oxy}-6-(hydroxymethyl)oxan-4-yl acetate

Statements

Identifiers

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