Structure of Desmethyl Tacrolimus CAS 132172-14-6

Desmethyl Tacrolimus CAS 132172-14-6

Identification

CAS Number

132172-14-6

Name

Desmethyl Tacrolimus

Synonyms

(18E)-17-Allyl-1,14,24-trihydroxy-12-[(1E)-1-(4-hydroxy-3-methoxycyclohexyl)-1-propen-2-yl]-23-methoxy-13,19,21,27-tetramethyl-11,28-dioxa-4-azatricyclo[23.2.1.04,9]octacos-18-en-2,3,10,16-tetron [German] [ACD/IUPAC Name]
(18E)-17-Allyl-1,14,24-trihydroxy-12-[(1E)-1-(4-hydroxy-3-methoxycyclohexyl)-1-propen-2-yl]-23-methoxy-13,19,21,27-tetramethyl-11,28-dioxa-4-azatricyclo[23.2.1.04,9]octacos-18-ene-2,3,10,16-tetrone [ACD/IUPAC Name]
(18E)-17-Allyl-1,14,24-trihydroxy-12-[(1E)-1-(4-hydroxy-3-méthoxycyclohexyl)-1-propén-2-yl]-23-méthoxy-13,19,21,27-tétraméthyl-11,28-dioxa-4-azatricyclo[23.2.1.04,9]octacos-18-ène-2,3,10,16-tétrone [French] [ACD/IUPAC Name]
16,19-Epoxy-3H-pyrido[2,1-c][1,4]oxaazacyclotricosine-1,7,20,21(4H,23H)-tetrone, 5,6,8,11,12,13,14,15,16,17,18,19,24,25,26,26a-hexadecahydro-5,15,19-trihydroxy-3-[(E)-2-(4-hydroxy-3-methoxycyclohexyl) -1-methylethenyl]-14-methoxy-4,10,12,18-tetramethyl-8-(2-propen-1-yl)-, (9E)- [ACD/Index Name]
132172-14-6 [RN]
13-Desmethyl FK 506
16,19-Epoxy-3H-pyrido(2,1-c)(1,4)oxaazacyclotricosine-1,7,20,21(4H,21H)-tetrone, 5,6,8,11,12,13,14,15,16,17,18,19,24,25,26,26a-hexadecahydro-5,15,19-trihydroxy-3-(2-(4-hydroxy-3-methoxycyclohexyl)-1-methylethenyl)-14-methoxy-4,10,12,18-tetramethyl-8-(2-propenyl)-, (3S-(3R(E(1S,3S,4S)),4S,5R,8S,9E,12R,14R,15S,16R,18S,19S,26aR))-

SMILES

CC1CC(C(C2CC(C(O2)(C(=O)C(=O)N3CCCCC3C(=O)OC(C(C(CC(=O)C(/C=C(/C1)\C)CC=C)O)C)/C(=C/C4CCC(C(C4)OC)O)/C)O)C)O)OC

StdInChI

InChI=1S/C43H67NO12/c1-9-12-30-18-24(2)17-25(3)19-36(54-8)38(48)37-21-27(5)43(52,56-37)40(49)41(50)44-16-11-10-13-31(44)42(51)55-39(28(6)33(46)23-34(30)47)26(4)20-29-14-15-32(45)35(22-29)53-7/h9,18,20,25,27-33,35-39,45-46,48,52H,1,10-17,19,21-23H2,2-8H3/b24-18+,26-20+

StdInChIKey

OKRZOXIQNKYTBL-AMASXYNMSA-N

Molecular Formula

C43H67NO12

Molecular Weight

789.99

Properties

Appearance

White powder

Safety Data

RIDADR 

NONH for all modes of transport

WGK Germany

3

Specifications and Other Information of Our Desmethyl Tacrolimus CAS 132172-14-6

Identification Methods

HNMR, HPLC

Purity

90% min

Shelf Life

2 years

Storage

Store at -20℃, sealed and away from light, use immediately after configuration.

Known Application

It is an impurity of Desmethyltacrolimus.

This product is developed by our R&D company Caming Pharmaceutical Ltd (https://www.caming.com/).

This product is developed by our R&D company Watson International Ltd (https://www.watson-int.com/).