3-[[(4-Methyl-1-piperazinyl)oxidoimino]methyl]rifamycin

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C43H58N4O13
Molecular Weight	838.9396
Optical Activity	UNSPECIFIED
Defined Stereocenters	9 / 9
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of 3-[[(4-Methyl-1-piperazinyl)oxidoimino]methyl]rifamycin

Structure Search

SMILES

CO[C@H]1\C=C\O[C@@]2(C)OC3=C(C2=O)C4=C(O)C(\C=[N+](/[O-])N5CCN(C)CC5)=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](OC(C)=O)[C@@H]1C)C(O)=C4C(O)=C3C

InChI

InChIKey=PADXLTATLMUKBQ-RIPAWWNWSA-N

InChI=1S/C43H58N4O13/c1-21-12-11-13-22(2)42(55)44-33-28(20-47(56)46-17-15-45(9)16-18-46)37(52)30-31(38(33)53)36(51)26(6)40-32(30)41(54)43(8,60-40)58-19-14-29(57-10)23(3)39(59-27(7)48)25(5)35(50)24(4)34(21)49/h11-14,19-21,23-25,29,34-35,39,49-53H,15-18H2,1-10H3,(H,44,55)/b12-11+,19-14+,22-13-,47-20-/t21-,23+,24+,25+,29-,34-,35+,39+,43-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C43H58N4O13
Molecular Weight	838.9396
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	9 / 9
E/Z Centers	1
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 17:51:58 GMT 2025` Edited by `admin` on `Wed Apr 02 17:51:58 GMT 2025`
Record UNII	NLU2QJ9LFM
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3-[[(4-Methyl-1-piperazinyl)oxidoimino]methyl]rifamycin

Systematic Name

English

2'-N-hydroxyrifampicin

Preferred Name

English

Rifamycin, 3-[[(4-methyl-1-piperazinyl)oxidoimino]methyl]-

Systematic Name

English

1-[(7S,9E,11S,12R,13S,14R,15R,16R,17S,18S,19E,21Z)-13-Acetyloxy-2,15,17,27,29-pentahydroxy-11-methoxy-3,7,12,14,16,18,22-heptamethyl-6,23-dioxo-8,30-dioxa-24-azatetracyclo[23.3.1.14,7.05,28]triaconta-1(29),2,4,9,19,21,25,27-octaen-26-yl]-N-(4-methylpiper

Systematic Name

English

Code System Code Type Description

CAS

51963-55-4

Created by admin on Wed Apr 02 17:51:58 GMT 2025 , Edited by admin on Wed Apr 02 17:51:58 GMT 2025

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FDA UNII

NLU2QJ9LFM

Created by admin on Wed Apr 02 17:51:58 GMT 2025 , Edited by admin on Wed Apr 02 17:51:58 GMT 2025

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PUBCHEM

135924346

Created by admin on Wed Apr 02 17:51:58 GMT 2025 , Edited by admin on Wed Apr 02 17:51:58 GMT 2025

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