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Cyclosporin A structure, CAS 121584-52-9

Cyclosporin A

CAS Number121584-52-9

Synonymsacetyl-cyclosporin A aldehyde; 6-[(3R,4R)-3-(Acetyloxy)-N,4-dimethyl-6-oxo-L-norleucine] Cyclosporin A; O-acetyl-CsA-aldehyde

Molecular FormulaC29H53N3O6

Molecular Weight539.74800

Purity

Density

Boiling Point

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Flash Point

Appearancewhite powder

EINECS

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Cat. No.: 2A-1168304 Purity:
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Quality Control of [ 121584-52-9 ] SDS Specification MoL

COA NMR CNMR HPLC LC-MS
Chemical & Physical Properties
CAS Number121584-52-9
Catalog No.2A-1168304
Chinese Name6-[(3R,4R)-3-(乙酰氧基)-N,4-二甲基-6-氧代-L-正亮氨酸]环孢菌素A
Synonymsacetyl-cyclosporin A aldehyde; 6-[(3R,4R)-3-(Acetyloxy)-N,4-dimethyl-6-oxo-L-norleucine] Cyclosporin A; O-acetyl-CsA-aldehyde
Molecular FormulaC29H53N3O6
Molecular Weight539.74800
Appearancewhite powder
Storage Condition2-8℃
PubChem ID16385468
SMILESCCC1NC(=O)C(C(OC(C)=O)C(C)CC=O)N(C)C(=O)C(C(C)C)N(C)C(=O)C(CC(C)C)N(C)C(=O)C(CC(C)C)N(C)C(=O)C(C)NC(=O)C(C)NC(=O)C(CC(C)C)N(C)C(=O)C(C(C)C)NC(=O)C(CC(C)C)N(C)C(=O)CN(C)C1=O
InChIInChI=1S/C62H109N11O14/c1-25-43-58(82)67(18)32-48(76)68(19)44(28-33(2)3)55(79)66-49(37(10)11)61(85)69(20)45(29-34(4)5)54(78)63-40(15)53(77)64-41(16)57(81)70(21)46(30-35(6)7)59(83)71(22)47(31-36(8)9)60(84)72(23)50(38(12)13)62(86)73(24)51(56(80)65-43)52(87-42(17)75)39(14)26-27-74/h27,33-41,43-47,49-52H,25-26,28-32H2,1-24H3,(H,63,78)(H,64,77)(H,65,80)(H,66,79)/t39-,40+,41-,43+,44+,45+,46+,47+,49+,50+,51+,52-/m1/s1
InChI KeyHPSRJUOXPOJSMJ-IBFGMFDFSA-N
Transport InfoProduct name: 6-[(3R,4R)-3-(acetoxy)-N,4-dimethyl-6-oxo-L-norleucine]-cyclosporine A
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