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(Q77422638)
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English
Dehydromonacolin N
bioactive natural product
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
344.198759376
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₁H₂₈O₄
0 references
canonical SMILES
O=C1OC(CC=C1)CCC2C(C=CC3=CC(C)CC(OC(=O)C)C32)C
0 references
isomeric SMILES
C[C@@H]1C[C@@H]([C@@H]2[C@H]([C@H](C=CC2=C1)C)CC[C@@H]3CC=CC(=O)O3)OC(=O)C
0 references
found in taxon
Monascus purpureus
1 reference
stated in
Cytotoxic dehydromonacolins from red yeast rice.
Identifiers
InChI
InChI=1S/C21H28O4/c1-13-11-16-8-7-14(2)18(21(16)19(12-13)24-15(3)22)10-9-17-5-4-6-20(23)25-17/h4,6-8,11,13-14,17-19,21H,5,9-10,12H2,1-3H3/t13-,14-,17-,18-,19-,21-/m0/s1
0 references
InChIKey
WIPNMFLFZURMNZ-GIVJZPSRSA-N
2 references
stated in
PubChem
PubChem CID
56957482
language of work or name
English
stated in
Natural Product Atlas
PubChem CID
56957482
language of work or name
English
PubChem CID
56957482
2 references
stated in
PubChem
PubChem CID
56957482
language of work or name
English
matched by identifier from
InChIKey
InChIKey
WIPNMFLFZURMNZ-GIVJZPSRSA-N
ChEBI ID
205184
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C21H28O4/c1-13-11-16-8-7-14(2)18(21(16)19(12-13)24-15(3)22)10-9-17-5-4-6-20(23)25-17/h4,6-8,11,13-14,17-19,21H,5,9-10,12H2,1-3H3/t13-,14-,17-,18-,19-,21-/m0/s1
UniChem compound ID
32582266
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA008408
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
WIPNMFLFZURMNZ-GIVJZPSRSA-N
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