Description
Rauvotetraphylline A is a natural alkaloid isolated from the herbs of Rauvolfia tetraphylla.
Synonyms
(betaE,6S,8R,9S,10S)-beta-Ethylidene-6,7,8,9,10,11-hexahydro-2-hydroxy-9-(hydroxymethyl)-12-methyl-6,10-imino-5H-cyclooct[b]indole-8-ethano
IUPAC Name
(1S,12S,13S,14R)-14-[(E)-1-hydroxybut-2-en-2-yl]-13-(hydroxymethyl)-16-methyl-3,16-diazatetracyclo[10.3.1.02,10.04,9]hexadeca-2(10),4(9),5,7-tetraen-7-ol
Molecular Formula
C20H26N2O3
Canonical SMILES
CC=C(CO)C1CC2C3=C(CC(C1CO)N2C)C4=C(N3)C=CC(=C4)O
InChI
InChI=1S/C20H26N2O3/c1-3-11(9-23)13-7-19-20-15(8-18(22(19)2)16(13)10-24)14-6-12(25)4-5-17(14)21-20/h3-6,13,16,18-19,21,23-25H,7-10H2,1-2H3/b11-3-/t13-,16-,18-,19-/m0/s1
InChIKey
MVGDPTFDPKCFEM-BKRWUIHZSA-N
Boiling Point
563.7±50.0°C (Predicted)
Density
1.272±0.06 g/cm3(Predicted)
pKa
10.22±0.60(Predicted)