114865-22-4

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Basic information

Product Name: cyclosporin A, 4-(2-butenyl)-4,4,N-trimethylthreonine(1)-
Synonyms: cyclosporin A, 4-(2-butenyl)-4,4,N-trimethylthreonine(1)-;(Mebm(2)T)(1)-csa;(Mebm2T)-csa;4-(2-Butenyl)-4,4,N-trimethyl-threonine(1)-cyclosporin a;4-(2-Butenyl)-4,4,N-trimethyl-Tyr(1)-cyclosporin a;6-((3R,6E)-6,7-Didehydro-3-hydroxy-N,4,4-trimethyl-L-2-aminooctanoic acid)cyclosporin a;Cyclosporin A, 6-((3R,6E)-6,7-didehydro-3-hydroxy-N,4,4-trimethyl-L-2-aminooctanoic acid)-;N-Methyl-4-((E)-2-butenyl)-4,4-dimethylthreonine cyclosporin a
CAS NO:114865-22-4
Molecular Formula: C63H113N11O12
Molecular Weight: 1216.63782
EINECS: N/A
Product Categories: N/A
Mol File: 114865-22-4.mol
Article Data: 1

Chemical Properties

Melting Point: 134-137 °C
Boiling Point: 1294.9°Cat760mmHg
Flash Point: 736.9°C
Appearance: /
Density: 1.014g/cm³
Vapor Pressure: 0mmHg at 25°C
Refractive Index: 1.467
Storage Temp.: N/A
Solubility: N/A
PKA: 13.32±0.70(Predicted)
CAS DataBase Reference: cyclosporin A, 4-(2-butenyl)-4,4,N-trimethylthreonine(1)-(CAS DataBase Reference)
NIST Chemistry Reference: cyclosporin A, 4-(2-butenyl)-4,4,N-trimethylthreonine(1)-(114865-22-4)
EPA Substance Registry System: cyclosporin A, 4-(2-butenyl)-4,4,N-trimethylthreonine(1)-(114865-22-4)

Safety Data

Hazard Codes: N/A
Statements: N/A
Safety Statements: N/A
WGK Germany:
RTECS:
HazardClass: N/A
PackingGroup: N/A
Hazardous Substances Data: 114865-22-4(Hazardous Substances Data)

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114865-22-4 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 114865-22-4 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,1,4,8,6 and 5 respectively; the second part has 2 digits, 2 and 2 respectively.
Calculate Digit Verification of CAS Registry Number 114865-22:
(8*1)+(7*1)+(6*4)+(5*8)+(4*6)+(3*5)+(2*2)+(1*2)=124
124 % 10 = 4
So 114865-22-4 is a valid CAS Registry Number.

InChI:InChI=1/C63H113N11O12/c1-26-28-29-63(17,18)52(76)51-56(80)66-43(27-2)58(82)68(19)34-48(75)69(20)44(30-35(3)4)55(79)67-49(39(11)12)61(85)70(21)45(31-36(5)6)54(78)64-41(15)53(77)65-42(16)57(81)71(22)46(32-37(7)8)59(83)72(23)47(33-38(9)10)60(84)73(24)50(40(13)14)62(86)74(51)25/h26,28,35-47,49-52,76H,27,29-34H2,1-25H3,(H,64,78)(H,65,77)(H,66,80)(H,67,79)/b28-26+/t41-,42+,43-,44-,45-,46+,47-,49-,50-,51?,52-/m0/s1

114865-22-4SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 19, 2017

Revision Date: Aug 19, 2017

1.Identification

1.1 GHS Product identifier

Product name	(3S,6S,9S,12R,15S,18S,21S,24S,30S)-30-ethyl-33-[(E,1R)-1-hydroxy-2,2-dimethylhex-4-enyl]-1,4,7,10,12,15,19,25,28-nonamethyl-6,9,18,24-tetrakis(2-methylpropyl)-3,21-di(propan-2-yl)-1,4,7,10,13,16,19,22,25,28,31-undecazacyclotritriacontane-2,5,8,11,14,17,20

1.2 Other means of identification

Product number	-
Other names	Bm2t-CsA

1.3 Recommended use of the chemical and restrictions on use

Identified uses	For industry use only.
Uses advised against	no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number	-
Service hours	Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:114865-22-4 SDS

114865-22-4Upstream product

124562-21-6 <(9-fluorenylmethyl)oxycarbonyl>-D-alanyl-N-methyl-L-leucyl-N-methyl-L-leucyl-N-methyl-L-valyl<(2S,3R,6E)-4,4-dimethyl-3-hydroxy-2-(methylamino)-6-octenoyl>-L-2-aminobutyryl-sarcosyl-N-methyl-L-leucyl-L-valyl-N-methyl-L-leucyl-L-alanine benzyl ester

114865-22-4Downstream Products

114865-22-4Relevant articles and documents

Synthesis, Conformation, and Immunosuppressive Activities of Three Analogues of Cyclosporin A Modified in the 1-Position

Aebi, Johannes D.,Deyo, Donald T.,Sun, Chong Qing,Guillaume, Dominique,Dunlap, Brian,Rich, Daniel H.

, p. 999 - 1009 (2007/10/02)

The syntheses of three new cyclosporin A (CsA) analogues that contain novel MeBmt derivatives in the 1-position are described.The MeBmt analogue that contains an additional methyl group on C4, (2S,3R,6E)-4,4-dimethyl-3-hydroxy-2-(N-methylamino)-6-octenoic

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