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Sporothrin A
bioactive natural product
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Statements
instance of
type of chemical entity
0 references
subclass of
7,15,26-Trihydroxyheptacyclo[19.7.1.02,11.02,20.03,8.014,19.025,29]nonacosa-1(29),3(8),4,6,14(19),15,17,20,22,25,27-undecaene-9,13,24-trione
1 reference
based on heuristic
inferred from SMILES
mass
462.110338296
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(2R,11R)-7,15,26-trihydroxyheptacyclo[19.7.1.02,11.02,20.03,8.014,19.025,29]nonacosa-1(29),3(8),4,6,14(19),15,17,20,22,25,27-undecaene-9,13,24-trione
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₉H₁₈O₆
0 references
canonical SMILES
O=C1C=CC=2C=3C(=CC=C(O)C13)C45C=6C=CC=C(O)C6C(=O)CC5CC(=O)C=7C(O)=CC=CC7C24
0 references
isomeric SMILES
C1[C@@H]2CC(=O)C3=C([C@@]24C5=C6C(=C4C7=C(C1=O)C(=CC=C7)O)C=CC(=O)C6=C(C=C5)O)C=CC=C3O
0 references
found in taxon
Sporothrix
1 reference
stated in
Three metabolites from the mangrove endophytic fungus Sporothrix sp. (#4335) from the South China Sea.
Daldinia eschscholtzii
1 reference
stated in
Unprecedented immunosuppressive polyketides from Daldinia eschscholzii, a mantis-associated fungus
Identifiers
InChI
InChI=1S/C29H18O6/c30-18-5-1-3-14-25(18)22(34)11-13-12-23(35)26-16(4-2-6-19(26)31)29(13)17-8-10-21(33)27-20(32)9-7-15(24(17)27)28(14)29/h1-10,13,30-31,33H,11-12H2/t13-,29-/m1/s1
0 references
InChIKey
JPASHCUBVCPLBJ-JYCIKRDWSA-N
2 references
stated in
PubChem
PubChem CID
25017172
language of work or name
English
stated in
Natural Product Atlas
PubChem CID
25017172
language of work or name
English
PubChem CID
25017172
2 references
stated in
PubChem
PubChem CID
25017172
language of work or name
English
matched by identifier from
InChIKey
InChIKey
JPASHCUBVCPLBJ-JYCIKRDWSA-N
ChEBI ID
214173
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C29H18O6/c30-18-5-1-3-14-25(18)22(34)11-13-12-23(35)26-16(4-2-6-19(26)31)29(13)17-8-10-21(33)27-20(32)9-7-15(24(17)27)28(14)29/h1-10,13,30-31,33H,11-12H2/t13-,29-/m1/s1
UniChem compound ID
30846747
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA014877
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
JPASHCUBVCPLBJ-JYCIKRDWSA-N
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