Home > Chiral Compounds> (3S,6S,9S,12R)-3-[(2S)-butan-2-yl]-6-[(1-methoxyindol-3-yl)methyl]-9-(6-oxooctyl)-1,4,7,10-tetrazabicyclo[10.4.0]hexadecane-2,5,8,11-tetrone

(3S,6S,9S,12R)-3-[(2S)-butan-2-yl]-6-[(1-methoxyindol-3-yl)methyl]-9-(6-oxooctyl)-1,4,7,10-tetrazabicyclo[10.4.0]hexadecane-2,5,8,11-tetrone

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Origin: China

Cas No: 183506-66-3

Specification: 99%min

Min order Quantity: 1 /kg

Supply Ability: 50 mt/month

Lead time: 7 days for OEM, 3 days for ready goods

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CAS No.: 183506-66-3 Formula: C33H47N5O6 Molecular Weight: 609.75600

Description

Apicidin is a fungal metabolite, as well as a histone deacetylase inhibitor.

Basic Info

Chemical Name	(3S,6S,9S,12R)-3-[(2S)-butan-2-yl]-6-[(1-methoxyindol-3-yl)methyl]-9-(6-oxooctyl)-1,4,7,10-tetrazabicyclo[10.4.0]hexadecane-2,5,8,11-tetrone
Synonyms	Acipidin; OSI-2040;
CAS No.	183506-66-3
Molecular Formula	C33H47N5O6
Molecular Weight	609.75600
PSA	138.84000
LogP	4.12130

Properties

Appearance & Physical State	Solid
Density	1.27g/cm3
Refractive Index	1.615
Storage Condition	-20ºC

Safety Info

Safety Statements	S22; S26; S36/37/39; S45
RIDADR	UN 2811 6.1/PG 2
Risk Statements	R26/27/28
Hazard Codes	T+

Synthesis Route

(3S,6S,9S,15aR)-9-((S)-sec-butyl)-3-(6-hydroxyoctyl)-6-((1-methoxy-1H-indol-3-yl)methyl)octahydro-2H-pyrido[1,2-a][1,4,7,10]tetraazacyclododecine-1,4,7,10(3H,12H)-tetraone→(3S,6S,9S,12R)-3-[(2S)-butan-2-yl]-6-[(1-methoxyindol-3-yl)methyl]-9-(6-oxooctyl)-1,4,7,10-tetrazabicyclo[10.4.0]hexadecane-2,5,8,11-tetrone
(S)-Fmoc-tryptophan methyl ester→(3S,6S,9S,12R)-3-[(2S)-butan-2-yl]-6-[(1-methoxyindol-3-yl)methyl]-9-(6-oxooctyl)-1,4,7,10-tetrazabicyclo[10.4.0]hexadecane-2,5,8,11-tetrone
1,5-Pentanediol→(3S,6S,9S,12R)-3-[(2S)-butan-2-yl]-6-[(1-methoxyindol-3-yl)methyl]-9-(6-oxooctyl)-1,4,7,10-tetrazabicyclo[10.4.0]hexadecane-2,5,8,11-tetrone

Precursor

1,5-Pentanediol
(3S,6S,9S,15aR)-9-((S)-sec-butyl)-3-(6-hydroxyoctyl)-6-((1-methoxy-1H-indol-3-yl)methyl)octahydro-2H-pyrido[1,2-a][1,4,7,10]tetraazacyclododecine-1,4,7,10(3H,12H)-tetraone
(S)-Fmoc-tryptophan methyl ester
BOC-L-Isoleucine

Downstream Product

(2S)-2-amino-8-oxodecanoic acid
L-isoleucine
D-pipecolic acid
L-tryptophan

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