11-Methoxyuncarine C

11-Methoxyuncarine C

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Catalog Number ACM61665085-1
CAS Number 61665-08-5
Synonyms Methyl(19α,20α)-11-methoxy-19-methyl-2-oxoformosanan-16-carboxylate
IUPAC Name methyl 6'-methoxy-1-methyl-2'-oxospiro[1,4a,5,5a,7,8,10,10a-octahydropyrano[3,4-f]indolizine-6,3'-1H-indole]-4-carboxylate
Molecular Weight 398.45
Molecular Formula C22H26N2O5
Canonical SMILES CC1C2CN3CCC4(C3CC2C(=CO1)C(=O)OC)C5=C(C=C(C=C5)OC)NC4=O
InChI InChI=1S/C22H26N2O5/c1-12-15-10-24-7-6-22(17-5-4-13(27-2)8-18(17)23-21(22)26)19(24)9-14(15)16(11-29-12)20(25)28-3/h4-5,8,11-12,14-15,19H,6-7,9-10H2,1-3H3,(H,23,26)
InChI Key SRKHGHLMEDVZRX-UHFFFAOYSA-N
Purity 98%
Appearance Solid
Complexity 739
Covalently-Bonded Unit Count 1
Defined Atom Stereocenter Count 0
Exact Mass 398.18417193
Heavy Atom Count 29
Hydrogen Bond Acceptor Count 6
Hydrogen Bond Donor Count 1
Monoisotopic Mass 398.18417193
PhysicalState Powder
Rotatable Bond Count 3
Topological Polar Surface Area 77.1 Ų

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