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(Q105283352)
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English
(6S)-6,8-dimethyl-5,7,17-triazatetracyclo[8.7.0.02,7.011,16]heptadeca-1,8,10,12,14,16-hexaene
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
Tabernine A
1 reference
based on heuristic
inferred from SMILES
mass
251.142247544
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₆H₁₇N₃
0 references
canonical SMILES
N1=C2C=CC=CC2=C3C=C(N4C(=C13)CCNC4C)C
0 references
isomeric SMILES
Cc1cc2c3ccccc3nc-2c2n1[C@@H](C)NCC2
0 references
found in taxon
Montana elegans
1 reference
stated in
Tabernines A-C, beta-carbolines from the leaves of Tabernaemontana elegans.
Identifiers
InChI
InChI=1S/C16H17N3/c1-10-9-13-12-5-3-4-6-14(12)18-16(13)15-7-8-17-11(2)19(10)15/h3-6,9,11,17H,7-8H2,1-2H3/t11-/m0/s1
0 references
InChIKey
VBMLQDYYOPHOCB-NSHDSACASA-N
0 references
PubChem CID
163195307
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
VBMLQDYYOPHOCB-NSHDSACASA-N
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