(+)-Isoajmaline

Catalog Number	ACM6989793
CAS Number	6989-79-3
IUPAC Name	(1R,9R,10S,12S,13R,14S,16S)-13-Ethyl-8-methyl-8,15-diazahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadeca-2,4,6-triene-14,18-diol
Molecular Weight	326.43
Molecular Formula	C20H26N2O2
Canonical SMILES	CCC1C2CC3C4C5(CC(C2C5O)N3C1O)C6=CC=CC=C6N4C
InChI	InChI=1S/C20H26N2O2/c1-3-10-11-8-14-17-20(12-6-4-5-7-13(12)21(17)2)9-15(16(11)18(20)23)22(14)19(10)24/h4-7,10-11,14-19,23-24H,3,8-9H2,1-2H3/t10-,11-,14+,15+,16?,17+,18?,19+,20-/m1/s1
InChI Key	CJDRUOGAGYHKKD-MLZVGHFESA-N
Purity	98%+ (HPLC)
Storage	Store in dry, low temperature, sealed, 2-8 °C.
Complexity	570
Exact Mass	326.199428076
Heavy Atom Count	24
Isomeric SMILES	CC[C@@H]1[C@H]2C[C@H]3[C@H]4[C@@]5(C[C@@H](C2C5O)N3[C@H]1O)C6=CC=CC=C6N4C
Monoisotopic Mass	326.199428076
Topological Polar Surface Area	46.9Ų

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