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(Q82904944)
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Annomutacin
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
(5S)-5-methyl-3-{2,8,15-trihydroxy-15-[(2R,5S)-5-(1-hydroxytridecyl)oxolan-2-yl]pentadecyl}-5H-furan-2-one
1 reference
based on heuristic
inferred from SMILES
annomontacin
1 reference
based on heuristic
inferred from SMILES
Cis-Annomontacin
1 reference
based on heuristic
inferred from SMILES
mass
624.496504516
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₃₇H₆₈O₇
0 references
canonical SMILES
O=C1OC(C=C1CC(O)CCCCCC(O)CCCCCCC(O)C2OC(CC2)C(O)CCCCCCCCCCCC)C
0 references
found in taxon
Annona montana
2 references
stated in
New cytotoxic monotetrahydrofuran annonaceous acetogenins from Annona muricata
stated in
Asitrilobins A and B: cytotoxic mono-THF annonaceous acetogenins from the seeds of Asimina triloba
Annona muricata
3 references
stated in
Montacin and cis-montacin, two new cytotoxic monotetrahydrofuran annonaceous acetogenins from Annona montana.
stated in
Asitrilobins A and B: cytotoxic mono-THF annonaceous acetogenins from the seeds of Asimina triloba
stated in
Annonaceous acetogenins of the seeds from Annona muricata
Asimina triloba
2 references
stated in
New cytotoxic monotetrahydrofuran annonaceous acetogenins from Annona muricata
stated in
Montacin and cis-montacin, two new cytotoxic monotetrahydrofuran annonaceous acetogenins from Annona montana.
Identifiers
InChI
InChI=1S/C37H68O7/c1-3-4-5-6-7-8-9-10-11-18-23-33(40)35-25-26-36(44-35)34(41)24-19-13-12-15-20-31(38)21-16-14-17-22-32(39)28-30-27-29(2)43-37(30)42/h27,29,31-36,38-41H,3-26,28H2,1-2H3
0 references
InChIKey
ALYPJDVVTYTPDW-UHFFFAOYSA-N
0 references
CAS Registry Number
137550-92-6
0 references
PubChem CID
132076
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
ChEBI ID
170877
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C37H68O7/c1-3-4-5-6-7-8-9-10-11-18-23-33(40)35-25-26-36(44-35)34(41)24-19-13-12-15-20-31(38)21-16-14-17-22-32(39)28-30-27-29(2)43-37(30)42/h27,29,31-36,38-41H,3-26,28H2,1-2H3
UniChem compound ID
31993129
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID00929828
0 references
DSSTOX compound identifier
DTXCID801358569
0 references
Human Metabolome Database ID
HMDB0031749
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
ALYPJDVVTYTPDW-UHFFFAOYSA-N
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