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(Q77513399)
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English
Xylariolide B
bioactive natural product
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No label defined
No description defined
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Statements
instance of
type of chemical entity
0 references
subclass of
5-(1,2-Dihydroxy-2-methylbutyl)-4-hydroxy-3,5-dimethyloxolan-2-one
1 reference
based on heuristic
inferred from SMILES
mass
232.13107374
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₁H₂₀O₅
0 references
canonical SMILES
O=C1OC(C)(C(O)C1C)C(O)C(O)(C)CC
0 references
isomeric SMILES
CCC(C)(O)C(O)[C@]1(C)OC(=O)[C@@H](C)[C@H]1O
0 references
found in taxon
Xylaria
1 reference
stated in
Seven Novel Linear Polyketides from Xylaria sp. NCY2
Identifiers
InChI
InChI=1S/C11H20O5/c1-5-10(3,15)9(14)11(4)7(12)6(2)8(13)16-11/h6-7,9,12,14-15H,5H2,1-4H3/t6-,7+,9?,10?,11+/m0/s1
0 references
InChIKey
YZLNVDIAWBBPRX-DCCRVTKTSA-N
2 references
stated in
PubChem
PubChem CID
46832766
language of work or name
English
stated in
Natural Product Atlas
PubChem CID
46832766
language of work or name
English
PubChem CID
46832766
2 references
stated in
PubChem
PubChem CID
46832766
language of work or name
English
matched by identifier from
InChIKey
InChIKey
YZLNVDIAWBBPRX-DCCRVTKTSA-N
ChEBI ID
227395
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C11H20O5/c1-5-10(3,15)9(14)11(4)7(12)6(2)8(13)16-11/h6-7,9,12,14-15H,5H2,1-4H3/t6-,7+,9?,10?,11+/m0/s1
UniChem compound ID
32690128
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA013139
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
YZLNVDIAWBBPRX-DCCRVTKTSA-N
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