Pyrido[4,3-c]cholestene, 2'-methoxy-

SpectraBase Compound ID	F2UaCoK6e5Y
InChI	InChI=1S/C31H49NO/c1-20(2)8-7-9-21(3)25-12-13-26-23-10-11-27-24-19-32-29(33-6)18-22(24)14-16-31(27,5)28(23)15-17-30(25,26)4/h18-21,23,25-28H,7-17H2,1-6H3
InChIKey	XMZHHEZAUHDMMC-UHFFFAOYSA-N Google Search
Mol Weight	451.7 g/mol
Molecular Formula	C31H49NO
Exact Mass	451.381415 g/mol

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SpectraBase Spectrum ID	Du1X6A00US3
Name	9-(1,5-DIMETHYLHEXYL)-3-METHOXY-6A,8A-DIMETHYL-6,6A,6B,7,8,8A,9,10,11,11A,11B,12,13,13A-TETRADECAHYDRO-5H-CYCLOPENTA[5,6]NAPHTHO[1,2-H]ISOQUINOLINE
Copyright	Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass	451.381415201 u
Formula	C31H49NO
InChI	InChI=1S/C31H49NO/c1-20(2)8-7-9-21(3)25-12-13-26-23-10-11-27-24-19-32-29(33-6)18-22(24)14-16-31(27,5)28(23)15-17-30(25,26)4/h18-21,23,25-28H,7-17H2,1-6H3
InChIKey	XMZHHEZAUHDMMC-UHFFFAOYSA-N
Molecular Weight	451.739 g/mol
Nominal Mass	451 u
Number of Peaks	240
SMILES	c1nc(cc2CCC3(C(c12)CCC1C2C(CCC31)(C(CC2)C(CCCC(C)C)C)C)C)OC
SPLASH	splash10-0udi-6921700000-1a38005f10940ba3497b
Source File Reference	LMCM-45421-861E
Synonyms	17-methoxy-1,5-dimethyl-6-(6-methylheptan-2-yl)-16-azapentacyclo[11.8.0.0(2,10).0(5,9).0(14,19)]henicosa-14(19),15,17-triene 9-(1,5-DIMETHYLHEXYL)-6A,8A-DIMETHYL-6,6A,6B,7,8,8A,9,10,11,11A,11B,12,13,13A-TETRADECAHYDRO-5H-CYCLOPENTA[5,6]NAPHTHO[1,2-H]ISOQUINOLIN-3-YL METHYL ETHER
Wiley ID	8_8148