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(Q105180525)
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English
1beta,2alpha,9-Trihydroxy-3,3-dimethyl-1,2,3,11-tetrahydropyrano[3,2-a]carbazole-5-carbaldehyde
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
1,2,9-trihydroxy-3,3-dimethyl-2,11-dihydro-1H-pyrano[3,2-a]carbazole-5-carbaldehyde
1 reference
based on heuristic
inferred from SMILES
mass
327.110672644
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
1alpha,2beta,9-Trihydroxy-3,3-dimethyl-1,2,3,11-tetrahydropyrano[3,2-a]carbazole-5-carbaldehyde
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₈H₁₇NO₅
0 references
canonical SMILES
O=CC=1C=C2C=3C=CC(O)=CC3NC2=C4C1OC(C)(C)C(O)C4O
0 references
isomeric SMILES
CC1(C)Oc2c(C=O)cc3c([nH]c4cc(O)ccc43)c2[C@@H](O)[C@@H]1O
0 references
found in taxon
Clausena excavata
1 reference
stated in
Alkaloidal and other constituents from the root bark of Clausena excavata
Identifiers
InChI
InChI=1S/C18H17NO5/c1-18(2)17(23)15(22)13-14-11(5-8(7-20)16(13)24-18)10-4-3-9(21)6-12(10)19-14/h3-7,15,17,19,21-23H,1-2H3/t15-,17+/m1/s1
0 references
InChIKey
NKDKVISDCZDDBO-WBVHZDCISA-N
0 references
PubChem CID
15815846
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
NKDKVISDCZDDBO-WBVHZDCISA-N
UniChem compound ID
96574163
1 reference
stated in
UniChem
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