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(Q105223182)
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English
methyl 12-[3-(2-aminoethyl)-1H-indol-6-yl]-15-ethylidene-18-(hydroxymethyl)-17-methyl-10,17-diazatetracyclo[12.3.1.03,11.04,9]octadeca-3(11),4,6,8-tetraene-18-carboxylate
group of stereoisomers with the chemical formula C₃₂H₃₈N₄O₃
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Statements
instance of
group of stereoisomers
0 references
subclass of
tryptamine alkaloid
1 reference
inferred from
tryptamine alkaloid
vobasine alkaloid
1 reference
inferred from
vobasine alkaloid
mass
526.294391076
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₃₂H₃₈N₄O₃
0 references
canonical SMILES
O=C(OC)C1(CO)C2C(=CC)CN(C)C1CC=3C=4C=CC=CC4NC3C(C=5C=CC6=C(C5)NC=C6CCN)C2
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Identifiers
InChI
InChI=1S/C32H38N4O3/c1-4-19-17-36(2)29-15-25-23-7-5-6-8-27(23)35-30(25)24(14-26(19)32(29,18-37)31(38)39-3)20-9-10-22-21(11-12-33)16-34-28(22)13-20/h4-10,13,16,24,26,29,34-35,37H,11-12,14-15,17-18,33H2,1-3H3
0 references
InChIKey
QKLBOXIFIITUPD-UHFFFAOYSA-N
0 references
PubChem CID
162940632
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
QKLBOXIFIITUPD-UHFFFAOYSA-N
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