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(Q104193659)
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English
Trichophycin A
group of stereoisomers with the chemical formula C₂₉H₄₇ClO₃
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
478.321373044
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₉H₄₇ClO₃
0 references
canonical SMILES
ClC=C(CC=1C=CC=CC1)CC(O)CCC(C)CC(C)C(O)CCCCC(C)C(O)CC=C
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found in taxon
Trichodesmium thiebautii
1 reference
stated in
Trichophycin A, a Cytotoxic Linear Polyketide Isolated from a Trichodesmium thiebautii Bloom
Oscillatoria thiebautii
1 reference
stated in
Trichophycin A, a Cytotoxic Linear Polyketide Isolated from a Trichodesmium thiebautii Bloom
Identifiers
InChI
InChI=1S/C29H47ClO3/c1-5-11-28(32)23(3)12-9-10-15-29(33)24(4)18-22(2)16-17-27(31)20-26(21-30)19-25-13-7-6-8-14-25/h5-8,13-14,21-24,27-29,31-33H,1,9-12,15-20H2,2-4H3
0 references
InChIKey
ORENNUJWZUSRAQ-UHFFFAOYSA-N
0 references
PubChem CID
139590413
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
ORENNUJWZUSRAQ-UHFFFAOYSA-N
ChEBI ID
212244
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C29H47ClO3/c1-5-11-28(32)23(3)12-9-10-15-29(33)24(4)18-22(2)16-17-27(31)20-26(21-30)19-25-13-7-6-8-14-25/h5-8,13-14,21-24,27-29,31-33H,1,9-12,15-20H2,2-4H3
UniChem compound ID
170913350
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID901047359
1 reference
matched by identifier from
InChIKey
InChIKey
ORENNUJWZUSRAQ-UHFFFAOYSA-N
Natural Product Atlas ID
NPA023121
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
ORENNUJWZUSRAQ-UHFFFAOYSA-N
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