methyl 3,4-didehydroibogamine-18-carboxylate

Chemical Structure Depiction of
methyl 3,4-didehydroibogamine-18-carboxylate
Available: 856 mg
Amount:
mg
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Compound characteristics

Compound ID: 0080-0011
Compound Name: methyl 3,4-didehydroibogamine-18-carboxylate
Molecular Weight: 336.43
Molecular Formula: C21 H24 N2 O2
Smiles: [H][C@]12C(CC)=C[C@H]3C[C@]1(C(=O)OC)c1c(CCN2C3)c2ccccc2[nH]1
Stereo: MIXTURE OF STEREOISOMERS
logP: 3.5769
logD: 3.5756
logSw: -3.6763
Hydrogen bond acceptors count: 4
Hydrogen bond donors count: 1
Polar surface area: 34.71
InChI Key: CMKFQVZJOWHHDV-LPLGYCIKSA-N
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