25-O-DEACETYLRIFABUTIN

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C44H60N4O10
Molecular Weight	804.968
Optical Activity	UNSPECIFIED
Defined Stereocenters	9 / 9
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CO[C@H]1\C=C\O[C@@]2(C)OC3=C(C2=O)C4=C(C(=O)C(NC(=O)C(C)=C\C=C\[C@H](C)[C@H](O)[C@@H](C)[C@@H](O)[C@@H](C)[C@H](O)[C@@H]1C)=C5NC6(CCN(CC(C)C)CC6)N=C45)C(O)=C3C

InChI

InChIKey=SCGFWNINBXENQT-FMPFFZOVSA-N

InChI=1S/C44H60N4O10/c1-21(2)20-48-17-15-44(16-18-48)46-32-29-30-38(52)27(8)40-31(29)41(54)43(9,58-40)57-19-14-28(56-10)24(5)36(50)26(7)37(51)25(6)35(49)22(3)12-11-13-23(4)42(55)45-34(39(30)53)33(32)47-44/h11-14,19,21-22,24-26,28,35-37,47,49-52H,15-18,20H2,1-10H3,(H,45,55)/b12-11+,19-14+,23-13-/t22-,24+,25+,26-,28-,35-,36+,37+,43-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C44H60N4O10
Molecular Weight	804.968
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	9 / 9
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 09:04:20 UTC 2023` Edited by `admin` on `Sat Dec 16 09:04:20 UTC 2023`
Record UNII	648I2I998A
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

25-O-DEACETYLRIFABUTIN

Common Name

English

LM-565

Code

English

ANTIBIOTIC LM-565

Code

English

16-DEACETYLRIFABUTIN

Common Name

English

SPIRO(9,4-(EPOXYPENTADECA(1,11,13)TRIENIMINO)-2H-FURO(2',3':7,8)NAPHTH(1,2-D)IMIDAZOLE-2,4'-PIPERIDINE)-5,10,26(3H,9H)-TRIONE, 6,16,18,20-TETRAHYDROXY-14-METHOXY-7,9,15,17,19,21,25-HEPTAMETHYL-1'-(2-METHYLPROPYL)-, (9S,12E,14S,15S,16S,17R,18R,19R,20S,21S

Systematic Name

English

25-O-DESACETYLRIFABUTIN

Common Name

English

16-DEACETYL RIFABUTIN

Common Name

English

RIFABUTIN IMPURITY E [EP IMPURITY]

Common Name

English

25-DESACETYLRIFABUTIN

Common Name

English

Code System Code Type Description

FDA UNII

648I2I998A

Created by admin on Sat Dec 16 09:04:21 UTC 2023 , Edited by admin on Sat Dec 16 09:04:21 UTC 2023

PRIMARY

CAS

100324-63-8

Created by admin on Sat Dec 16 09:04:21 UTC 2023 , Edited by admin on Sat Dec 16 09:04:21 UTC 2023

PRIMARY

PUBCHEM

6476667

Created by admin on Sat Dec 16 09:04:21 UTC 2023 , Edited by admin on Sat Dec 16 09:04:21 UTC 2023

PRIMARY

Related Record Type Details


					1W306TDA6S

RIFABUTIN

PARENT -> METABOLITE ACTIVE

Related Record Type Details


					1W306TDA6S

RIFABUTIN

PARENT -> IMPURITY

Interaction Type:

CHROMATOGRAPHIC PURITY (HPLC/UV)

Qualification:

EP

Amount: