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(Q77501413)
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English
Cyathatriol
bioactive natural product
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No label defined
No description defined
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Statements
instance of
type of chemical entity
0 references
subclass of
8-(Hydroxymethyl)-3a,5a-dimethyl-1-propan-2-yl-2,3,4,5,6,9,10,10a-octahydrocyclohepta[e]indene-6,9-diol
1 reference
based on heuristic
inferred from SMILES
mass
320.235144884
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(3aR,5aR,6R,9R,10aR)-8-(hydroxymethyl)-3a,5a-dimethyl-1-propan-2-yl-2,3,4,5,6,9,10,10a-octahydrocyclohepta[e]indene-6,9-diol
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₀H₃₂O₃
0 references
canonical SMILES
OCC1=CC(O)C2(C)CCC3(C(=C(CC3)C(C)C)C2CC1O)C
0 references
isomeric SMILES
CC(C)C1=C2[C@H]3C[C@@H](O)C(CO)=C[C@H](O)[C@]3(C)CC[C@@]2(C)CC1
0 references
found in taxon
Cyathus africanus
1 reference
stated in
Metabolites of bird's nest fungi. Part 11. Diterpenoid metabolites of Cyathusearlei Lloyd
Identifiers
InChI
InChI=1S/C20H32O3/c1-12(2)14-5-6-19(3)7-8-20(4)15(18(14)19)10-16(22)13(11-21)9-17(20)23/h9,12,15-17,21-23H,5-8,10-11H2,1-4H3/t15-,16-,17+,19-,20-/m1/s1
0 references
InChIKey
YQGDZWWLYAMTAU-HPUSYDDDSA-N
2 references
stated in
PubChem
PubChem CID
101316898
language of work or name
English
stated in
Natural Product Atlas
PubChem CID
101316898
language of work or name
English
PubChem CID
101316898
2 references
stated in
PubChem
PubChem CID
101316898
language of work or name
English
matched by identifier from
InChIKey
InChIKey
YQGDZWWLYAMTAU-HPUSYDDDSA-N
ChEBI ID
194349
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C20H32O3/c1-12(2)14-5-6-19(3)7-8-20(4)15(18(14)19)10-16(22)13(11-21)9-17(20)23/h9,12,15-17,21-23H,5-8,10-11H2,1-4H3/t15-,16-,17+,19-,20-/m1/s1
UniChem compound ID
97121392
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA011224
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
YQGDZWWLYAMTAU-HPUSYDDDSA-N
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