RIFABUTIN N-OXIDE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C46H62N4O12
Molecular Weight	863.0041
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](OC(C)=O)[C@@H]1C)=C5NC6(CC[N+]([O-])(CC(C)C)CC6)N=C45)C(O)=C3C

InChI

InChIKey=HVQQNDMUDPTBRO-ZZKRMFRKSA-N

InChI=1S/C46H62N4O12/c1-22(2)21-50(58)18-16-46(17-19-50)48-34-31-32-39(54)28(8)42-33(31)43(56)45(10,62-42)60-20-15-30(59-11)25(5)41(61-29(9)51)27(7)38(53)26(6)37(52)23(3)13-12-14-24(4)44(57)47-36(40(32)55)35(34)49-46/h12-15,20,22-23,25-27,30,37-38,41,49,52-54H,16-19,21H2,1-11H3,(H,47,57)/b13-12+,20-15+,24-14-/t23-,25+,26+,27+,30-,37-,38+,41+,45-,46?,50?/m0/s1

HIDE SMILES / InChI

Approval Year

Name

Type

Language

RIFABUTIN N-OXIDE

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, 16-(ACETYLOXY)-6,18,20-TRIHYDROXY-14-METHOXY-7,9,15,17,19,21,25-HEPTAMETHYL-1'-(2-METHYLPROPYL)-, 1'-OXIDE, (9S,12E,14S,15R,16S

Systematic Name

English

Code System Code Type Description

CAS

645406-37-7

Created by admin on Sat Dec 16 18:37:31 GMT 2023 , Edited by admin on Sat Dec 16 18:37:31 GMT 2023

PRIMARY

FDA UNII

YV9AXM7YCC

Created by admin on Sat Dec 16 18:37:31 GMT 2023 , Edited by admin on Sat Dec 16 18:37:31 GMT 2023

PRIMARY

SUBSTANCE RECORD


					YV9AXM7YCC

RIFABUTIN N-OXIDE