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(Q77519679)
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English
Tricholomalide B
bioactive natural product
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Statements
instance of
type of chemical entity
0 references
subclass of
4-hydroxy-4-(3-hydroxyprop-1-en-2-yl)-3a,8a-dimethyl-8-propan-2-yl-7,8,9,9a-tetrahydro-3H-azuleno[5,6-b]furan-2,6-dione
1 reference
based on heuristic
inferred from SMILES
mass
348.193673996
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(+/-)-Tricholomalide B
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₀H₂₈O₅
0 references
canonical SMILES
O=C1OC2CC3(C(=CC(O)(C(=C)CO)C2(C)C1)C(=O)CC3C(C)C)C
0 references
isomeric SMILES
C=C(CO)[C@@]1(O)C=C2C(=O)C[C@@H](C(C)C)[C@]2(C)C[C@H]2OC(=O)C[C@]21C
0 references
found in taxon
Tricholoma
1 reference
stated in
Tricholomalides A-C, new neurotrophic diterpenes from the mushroom Tricholoma sp.
Identifiers
InChI
InChI=1S/C20H28O5/c1-11(2)13-6-15(22)14-7-20(24,12(3)10-21)19(5)9-17(23)25-16(19)8-18(13,14)4/h7,11,13,16,21,24H,3,6,8-10H2,1-2,4-5H3/t13-,16+,18-,19+,20-/m0/s1
0 references
InChIKey
CMFMNGXFTLTMOH-XAYHPSFQSA-N
2 references
stated in
PubChem
PubChem CID
11473506
language of work or name
English
stated in
Natural Product Atlas
PubChem CID
11473506
language of work or name
English
PubChem CID
11473506
2 references
stated in
PubChem
PubChem CID
11473506
language of work or name
English
matched by identifier from
InChIKey
InChIKey
CMFMNGXFTLTMOH-XAYHPSFQSA-N
ChEBI ID
210253
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C20H28O5/c1-11(2)13-6-15(22)14-7-20(24,12(3)10-21)19(5)9-17(23)25-16(19)8-18(13,14)4/h7,11,13,16,21,24H,3,6,8-10H2,1-2,4-5H3/t13-,16+,18-,19+,20-/m0/s1
UniChem compound ID
537582
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA014129
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
CMFMNGXFTLTMOH-XAYHPSFQSA-N
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