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(Q104961497)
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Rickiol A2
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
macrolides
0 references
mass
428.313789128
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₄H₄₄O₆
0 references
canonical SMILES
O=C1OC(CC(O)C)CC(O)CCCCCCCCCCCCC(O)CC(O)C=C1
0 references
isomeric SMILES
C[C@@H](O)C[C@@H]1C[C@H](O)CCCCCCCCCCCC[C@H](O)C[C@H](O)/C=C/C(=O)O1
0 references
found in taxon
Hypoxylon rickii
1 reference
stated in
The Rickiols: 20-, 22-, and 24-membered Macrolides from the Ascomycete Hypoxylon rickii.
Identifiers
InChI
InChI=1S/C24H44O6/c1-19(25)16-23-18-21(27)13-11-9-7-5-3-2-4-6-8-10-12-20(26)17-22(28)14-15-24(29)30-23/h14-15,19-23,25-28H,2-13,16-18H2,1H3/b15-14+/t19-,20+,21-,22-,23-/m1/s1
0 references
InChIKey
CJPMQHIEMPGDOF-GWKOXTCVSA-N
0 references
PubChem CID
146683943
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
CJPMQHIEMPGDOF-GWKOXTCVSA-N
ChEBI ID
214942
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C24H44O6/c1-19(25)16-23-18-21(27)13-11-9-7-5-3-2-4-6-8-10-12-20(26)17-22(28)14-15-24(29)30-23/h14-15,19-23,25-28H,2-13,16-18H2,1H3/b15-14+/t19-,20+,21-,22-,23-/m1/s1
UniChem compound ID
178087299
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA027665
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
CJPMQHIEMPGDOF-GWKOXTCVSA-N
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