Humantenmine

Humantenmine

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Catalog Number ACM82354389
CAS Number 82354-38-9
Synonyms Gelsenicine
IUPAC Name (1R,2S,4S,7R,8S)-6-Ethyl-1'-methoxyspiro[10-oxa-5-azatricyclo[5.3.1.04,8]undec-5-ene-2,3'-indole]-2'-one
Molecular Weight 326.39
Molecular Formula C19H22N2O3
Canonical SMILES CCC1=NC2CC3(C4CC1C2CO4)C5=CC=CC=C5N(C3=O)OC
InChI InChI=1S/C19H22N2O3/c1-3-14-11-8-17-19(9-15(20-14)12(11)10-24-17)13-6-4-5-7-16(13)21(23-2)18(19)22/h4-7,11-12,15,17H,3,8-10H2,1-2H3/t11-,12+,15+,17-,19+/m1/s1
InChI Key BIGABVPVCRHEES-NWPJSNQLSA-N
Purity 98%+ (HPLC)
Storage Store in dry, low temperature, sealed, 2-8 °C.
Complexity 591
Exact Mass 326.16304257
Heavy Atom Count 24
Isomeric SMILES CCC1=N[C@H]2C[C@@]3([C@H]4C[C@@H]1[C@@H]2CO4)C5=CC=CC=C5N(C3=O)OC
Monoisotopic Mass 326.16304257
Topological Polar Surface Area 51.1Ų

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