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Details

Stereochemistry ABSOLUTE
Molecular Formula C39H49NO14
Molecular Weight 755.8047
Optical Activity UNSPECIFIED
Defined Stereocenters 9 / 9
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of RIFAMYCIN B

SMILES

CO[C@H]1\C=C\O[C@@]2(C)OC3=C(C2=O)C4=C(OCC(O)=O)C=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=SQTCRTQCPJICLD-KTQDUKAHSA-N
InChI=1S/C39H49NO14/c1-17-11-10-12-18(2)38(49)40-24-15-26(51-16-27(42)43)28-29(34(24)47)33(46)22(6)36-30(28)37(48)39(8,54-36)52-14-13-25(50-9)19(3)35(53-23(7)41)21(5)32(45)20(4)31(17)44/h10-15,17,19-21,25,31-32,35,44-47H,16H2,1-9H3,(H,40,49)(H,42,43)/b11-10+,14-13+,18-12-/t17-,19+,20+,21+,25-,31-,32+,35+,39-/m0/s1

HIDE SMILES / InChI

Molecular Formula C39H49NO14
Molecular Weight 755.8047
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 9 / 9
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

PubMed

PubMed

TitleDatePubMed
The rifamycins.
1963
Patents
Substance Class Chemical
Created
by admin
on Fri Dec 15 15:23:10 UTC 2023
Edited
by admin
on Fri Dec 15 15:23:10 UTC 2023
Record UNII
8DDB535DJI
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
RIFAMYCIN B
MI  
Common Name English
NSC-145604
Code English
RIFAMYCIN B [MI]
Common Name English
4-O-(CARBOXYMETHYL)RIFAMYCIN
Common Name English
NANCIMYCIN
Common Name English
((2S,12Z,14E,16S,17S,18R,19R,20R,21S,22R,23S,24E)-21-(ACETYLOXY)-5,6,17,19-TETRAHYDROXY-23-METHOXY-2,4,12,16,18,20,22-HEPTAMETHYL-1,11-DIOXO-1,2-DIHYDRO-2,7-(EPOXYPENTADECA(1,11,13)TRIENAZANO)NAPHTHO(2,1-B)FURAN-9-YL)ACETIC ACID
Systematic Name English
RIFAXIMIN IMPURITY B [EP IMPURITY]
Common Name English
RIFAMYCIN SODIUM IMPURITY A [EP IMPURITY]
Common Name English
Code System Code Type Description
CHEBI
58306
Created by admin on Fri Dec 15 15:23:11 UTC 2023 , Edited by admin on Fri Dec 15 15:23:11 UTC 2023
PRIMARY
CHEBI
17876
Created by admin on Fri Dec 15 15:23:11 UTC 2023 , Edited by admin on Fri Dec 15 15:23:11 UTC 2023
PRIMARY
EPA CompTox
DTXSID901037384
Created by admin on Fri Dec 15 15:23:11 UTC 2023 , Edited by admin on Fri Dec 15 15:23:11 UTC 2023
PRIMARY
FDA UNII
8DDB535DJI
Created by admin on Fri Dec 15 15:23:11 UTC 2023 , Edited by admin on Fri Dec 15 15:23:11 UTC 2023
PRIMARY
MESH
C033974
Created by admin on Fri Dec 15 15:23:11 UTC 2023 , Edited by admin on Fri Dec 15 15:23:11 UTC 2023
PRIMARY
CAS
13929-35-6
Created by admin on Fri Dec 15 15:23:11 UTC 2023 , Edited by admin on Fri Dec 15 15:23:11 UTC 2023
PRIMARY
ECHA (EC/EINECS)
237-697-8
Created by admin on Fri Dec 15 15:23:11 UTC 2023 , Edited by admin on Fri Dec 15 15:23:11 UTC 2023
PRIMARY
NSC
145604
Created by admin on Fri Dec 15 15:23:11 UTC 2023 , Edited by admin on Fri Dec 15 15:23:11 UTC 2023
PRIMARY
MERCK INDEX
m9612
Created by admin on Fri Dec 15 15:23:11 UTC 2023 , Edited by admin on Fri Dec 15 15:23:11 UTC 2023
PRIMARY Merck Index
PUBCHEM
5459948
Created by admin on Fri Dec 15 15:23:11 UTC 2023 , Edited by admin on Fri Dec 15 15:23:11 UTC 2023
PRIMARY
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EP