5H-[1,3]Dioxolo[4,5-h]-1,3-dioxolo[4,5]cyclopenta[1,2-a]pyrrolo[2,1-b][3]benzazepine, cephalotaxine deriv.

SpectraBase Compound ID	3EPqZ3WEV3b
InChI	InChI=1S/C22H27NO6/c1-12(24)27-18-10-23-6-4-5-22(23)9-17-20(29-21(2,3)28-17)19(22)14-8-16-15(7-13(14)18)25-11-26-16/h7-8,17-20H,4-6,9-11H2,1-3H3/t17?,18?,19-,20-,22+/m1/s1
InChIKey	QTCZISORZBMMDK-DCJSUYLZSA-N Google Search
Mol Weight	401.46 g/mol
Molecular Formula	C22H27NO6
Exact Mass	401.183838 g/mol

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SpectraBase Spectrum ID	FOQFLaVurHs
Name	5H-[1,3]Dioxolo[4,5-h]-1,3-dioxolo[4,5]cyclopenta[1,2-a]pyrrolo[2,1-b][3]benzazepine, cephalotaxine deriv.
Alternate Name(s)	Cephalotaxine, 11-(acetyloxy)-2-demethoxy-3-deoxy-1,2-dihydro-2,3-[(1-methylethylidene)bis(oxy)]-, (2.beta.,3.beta.,11.alpha.)-(.+-.)- (3a.alpha.,4S(*),10.beta.,15b.beta.,15c.alpha.)-(+-)-10-acetoxy-3a,4,6,7,9,10,15b,15c-octahydro-2,2-dimethyl-5H-[1,3]dioxolo[4,5-h]-1,3-dioxolo[4,5]cyclopenta[1,2-a]pyrrolo[2,1-b][3]benzaepine (4aS,15bS,15cS)-2,2-dimethyl-3a,4,6,7,9,10,15b,15c-octahydro-5H-[1,3]dioxolo[4',5':4,5]cyclopenta[1,2-a][1,3]dioxolo[4,5-h]pyrrolo[2,1-b][3]benzazepin-10-yl acetate
CAS Registry Number	130611-20-0
Comments	Less than 3 mono-isotopic peaks
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C22H27NO6
InChI	InChI=1S/C22H27NO6/c1-12(24)27-18-10-23-6-4-5-22(23)9-17-20(29-21(2,3)28-17)19(22)14-8-16-15(7-13(14)18)25-11-26-16/h7-8,17-20H,4-6,9-11H2,1-3H3/t17?,18?,19-,20-,22+/m1/s1
InChIKey	QTCZISORZBMMDK-DCJSUYLZSA-N
Molecular Weight	401.459 g/mol
SMILES	[C@@]123[C@](c4c(cc5c(c4)OCO5)C(CN2CCC3)OC(=O)C)([C@@]2(OC(OC2C1)(C)C)[H])[H]
SPLASH	splash10-0006-0009200000-897826c3e79fde7dc263
Source of Spectrum	C-112-9611-37
Wiley ID	1369995