(Q105215012)

English

(4R,5S,6E)-5,16,18-trihydroxy-4-methyl-3-oxabicyclo[12.4.0]octadeca-1(14),6,15,17-tetraene-2,12-dione

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

macrolides

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mass

334.141638424 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₈H₂₂O₆

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canonical SMILES

O=C1OC(C)C(O)C=CCCCCC(=O)CC=2C=C(O)C=C(O)C12

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isomeric SMILES

C[C@H]1OC(=O)c2c(O)cc(O)cc2CC(=O)CCCC/C=C/[C@@H]1O

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found in taxon

Metacordyceps chlamydosporia

1 reference

stated in

Antibacterial Radicicol Analogues from Pochonia chlamydosporia and Their Biosynthetic Gene Cluster

Paecilomyces

1 reference

stated in

Antifungal and Cytotoxic β-Resorcylic Acid Lactones from a Paecilomyces Species.

Identifiers

InChI

InChI=1S/C18H22O6/c1-11-15(21)7-5-3-2-4-6-13(19)8-12-9-14(20)10-16(22)17(12)18(23)24-11/h5,7,9-11,15,20-22H,2-4,6,8H2,1H3/b7-5+/t11-,15+/m1/s1

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InChIKey

PUBJBUSNXLSOQM-YWDVGMFKSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

PUBJBUSNXLSOQM-YWDVGMFKSA-N

ChEBI ID

206829

mapping relation type

exact match

1 reference

matched by identifier from

International Chemical Identifier

InChI

InChI=1S/C18H22O6/c1-11-15(21)7-5-3-2-4-6-13(19)8-12-9-14(20)10-16(22)17(12)18(23)24-11/h5,7,9-11,15,20-22H,2-4,6,8H2,1H3/b7-5+/t11-,15+/m1/s1

1 reference

Natural Product Atlas ID

NPA026290

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

PUBJBUSNXLSOQM-YWDVGMFKSA-N

(Q105215012)

(4R,5S,6E)-5,16,18-trihydroxy-4-methyl-3-oxabicyclo[12.4.0]octadeca-1(14),6,15,17-tetraene-2,12-dione

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