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(Q105146663)
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English
(E,3S)-2,6-dimethyl-7-(9H-pyrido[3,4-b]indol-1-yl)hept-6-ene-2,3-diol
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
2,6-dimethyl-7-(9H-pyrido[3,4-b]indol-1-yl)hept-6-ene-2,3-diol
1 reference
based on heuristic
inferred from SMILES
(6E)-2,6-dimethyl-7-{9H-pyrido[3,4-b]indol-1-yl}hept-6-ene-2,3-diol
1 reference
based on heuristic
inferred from SMILES
mass
324.183778008
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₀H₂₄N₂O₂
0 references
canonical SMILES
OC(CCC(=CC1=NC=CC=2C=3C=CC=CC3NC12)C)C(O)(C)C
0 references
isomeric SMILES
C/C(=C\c1nccc2c1[nH]c1ccccc12)CC[C@H](O)C(C)(C)O
0 references
found in taxon
Hedyotis capitellata
2 references
stated in
Capitelline - A New Indole Alkaloid fromHedyotis capitellata
stated in
β-Carboline alkaloids from Hedyotis capitellata
Identifiers
InChI
InChI=1S/C20H24N2O2/c1-13(8-9-18(23)20(2,3)24)12-17-19-15(10-11-21-17)14-6-4-5-7-16(14)22-19/h4-7,10-12,18,22-24H,8-9H2,1-3H3/b13-12+/t18-/m0/s1
0 references
InChIKey
KVQPNMBBLKBBEG-HHNLSAEISA-N
0 references
PubChem CID
162919831
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
KVQPNMBBLKBBEG-HHNLSAEISA-N
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