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(Q105203516)
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English
daldinone C
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
336.099773612
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
Daldinone A
1 reference
based on heuristic
inferred from InChI
(2S,11S,12S)-2,7,17-trihydroxypentacyclo[10.7.1.02,11.03,8.016,20]icosa-1(20),3(8),4,6,16,18-hexaene-9,15-dione
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₀H₁₆O₅
0 references
canonical SMILES
O=C1C=2C(O)=CC=C3C2C(CC1)C4CC(=O)C=5C(O)=CC=CC5C34O
0 references
isomeric SMILES
O=C1C[C@H]2[C@@H]3CCC(=O)c4c(O)ccc(c43)[C@@]2(O)c2cccc(O)c21
0 references
found in taxon
Annulohypoxylon truncatum
3 references
stated in
Cytotoxic benzo[j]fluoranthene metabolites from Hypoxylon truncatum IFB-18, an endophyte of Artemisia annua
stated in
Cytotoxic benzo[j]fluoranthene metabolites from Hypoxylon truncatum IFB-18, an endophyte of Artemisia annua
stated in
Cytotoxic Benzo[j]fluoranthene Metabolites from Hypoxylon truncatum IFB-18, an Endophyte of Artemisia annua
Identifiers
InChI
InChI=1S/C20H16O5/c21-13-3-1-2-10-18(13)16(24)8-12-9-4-6-14(22)19-15(23)7-5-11(17(9)19)20(10,12)25/h1-3,5,7,9,12,21,23,25H,4,6,8H2/t9-,12-,20-/m0/s1
0 references
InChIKey
OYRYUFABCKQXTO-TVLKGPQESA-N
0 references
PubChem CID
16104916
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
OYRYUFABCKQXTO-TVLKGPQESA-N
ChEBI ID
208485
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C20H16O5/c21-13-3-1-2-10-18(13)16(24)8-12-9-4-6-14(22)19-15(23)7-5-11(17(9)19)20(10,12)25/h1-3,5,7,9,12,21,23,25H,4,6,8H2/t9-,12-,20-/m0/s1
UniChem compound ID
33149678
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA009397
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
OYRYUFABCKQXTO-TVLKGPQESA-N
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