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Gibberellin A7
bioactive natural product
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Statements
instance of
type of chemical entity
0 references
subclass of
(1R,2R,5R,8R,9S,10R,12S)-12-hydroxy-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.1⁵,⁸.0¹,¹⁰.0²,⁸]heptadec-13-ene-9-carboxylic acid
1 reference
based on heuristic
inferred from SMILES
12-Hydroxy-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.15,8.01,10.02,8]heptadec-13-ene-9-carboxylic acid
1 reference
based on heuristic
inferred from SMILES
mass
330.146723804
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
gibberellin a7
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₉H₂₂O₅
0 references
canonical SMILES
O=C(O)C1C2C3(OC(=O)C2(C)C(O)C=C3)C4CCC5C(=C)CC14C5
0 references
isomeric SMILES
C[C@]12[C@H](C=C[C@@]3([C@@H]1[C@@H]([C@]45[C@H]3CC[C@H](C4)C(=C)C5)C(=O)O)OC2=O)O
0 references
found in taxon
Gibberella fujikuroi
1 reference
stated in
New metabolites of Gibberella fujikuroi—I
Fusarium fujikuroi
1 reference
stated in
New metabolites of Gibberella fujikuroi—I
Identifiers
InChI
InChI=1S/C19H22O5/c1-9-7-18-8-10(9)3-4-11(18)19-6-5-12(20)17(2,16(23)24-19)14(19)13(18)15(21)22/h5-6,10-14,20H,1,3-4,7-8H2,2H3,(H,21,22)/t10-,11-,12+,13-,14-,17+,18+,19-/m1/s1
0 references
InChIKey
SEEGHKWOBVVBTQ-UKJRIFTCSA-N
2 references
stated in
PubChem
PubChem CID
11587958
language of work or name
English
stated in
Natural Product Atlas
PubChem CID
11587958
language of work or name
English
PubChem CID
11587958
1 reference
stated in
PubChem
PubChem CID
11587958
language of work or name
English
ChEBI ID
188778
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C19H22O5/c1-9-7-18-8-10(9)3-4-11(18)19-6-5-12(20)17(2,16(23)24-19)14(19)13(18)15(21)22/h5-6,10-14,20H,1,3-4,7-8H2,2H3,(H,21,22)/t10-,11-,12+,13-,14-,17+,18+,19-/m1/s1
SureChEMBL ID
SCHEMBL383020
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
SEEGHKWOBVVBTQ-UKJRIFTCSA-N
UniChem compound ID
32614563
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA007600
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
SEEGHKWOBVVBTQ-UKJRIFTCSA-N
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