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(Q75069929)
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English
14-Deoxy-11,12-didehydroandrographolide
bioactive natural product
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Statements
instance of
type of chemical entity
0 references
subclass of
4-[(E)-2-[(4aS,5R)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethenyl]-2H-furan-5-one
1 reference
based on heuristic
inferred from SMILES
4-[2-[6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethenyl]-2H-furan-5-one
1 reference
based on heuristic
inferred from SMILES
mass
332.198759376
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
14-deoxy-11,12-dehydroandrographolide
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(9alpha,10alpha)-3alpha,15,18-Trihydroxylabda-8(20),11,13-trien-16-oic acid gamma-lactone
1 reference
based on heuristic
inferred from InChI
4-[(E)-2-[(1S,4aS,5R,6R,8aR)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethenyl]-2H-furan-5-one
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₀H₂₈O₄
0 references
canonical SMILES
O=C1OCC=C1C=CC2C(=C)CCC3C(C)(CO)C(O)CCC23C
0 references
isomeric SMILES
C[C@]12CC[C@@H]([C@]([C@@H]1CCC(=C)[C@@H]2/C=C/C3=CCOC3=O)(C)CO)O
0 references
found in taxon
Taiwanofungus camphoratus
2 references
stated in
Neuroprotective diterpenes from the fruiting body of Antrodia camphorata.
stated in
Neuroprotective diterpenes from the fruiting body of Antrodia camphorata.
Identifiers
InChI
InChI=1S/C20H28O4/c1-13-4-7-16-19(2,10-8-17(22)20(16,3)12-21)15(13)6-5-14-9-11-24-18(14)23/h5-6,9,15-17,21-22H,1,4,7-8,10-12H2,2-3H3/b6-5+/t15-,16+,17-,19+,20+/m0/s1
0 references
InChIKey
XMJAJFVLHDIEHF-YFFHYEMFSA-N
2 references
stated in
PubChem
PubChem CID
44583846
language of work or name
English
stated in
Natural Product Atlas
PubChem CID
44583846
language of work or name
English
PubChem CID
44583846
2 references
stated in
PubChem
PubChem CID
44583846
language of work or name
English
matched by identifier from
InChIKey
InChIKey
XMJAJFVLHDIEHF-YFFHYEMFSA-N
UniChem compound ID
131451
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA003129
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
XMJAJFVLHDIEHF-YFFHYEMFSA-N
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