SEMDURAMICIN SODIUM

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C45H75O16.Na
Molecular Weight	895.0572
Optical Activity	UNSPECIFIED
Defined Stereocenters	23 / 23
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[Na+].[H][C@@]1(C[C@H](O[C@H]2CC[C@H](OC)[C@@H](C)O2)[C@@]([H])(O1)[C@]3(C)CC[C@@]([H])(O3)[C@]4(C)CC[C@]5(C[C@H](O)[C@@H](C)[C@]([H])(O5)[C@@H](C)[C@]6([H])O[C@](O)(CC([O-])=O)[C@@H](C)[C@H](O)[C@H]6OC)O4)[C@@]7([H])O[C@](C)(O)[C@H](C)C[C@@H]7C

InChI

InChIKey=JXRFTGPGWGUBQB-LHOUOPCDSA-M

InChI=1S/C45H76O16.Na/c1-22-18-23(2)43(9,50)58-36(22)30-19-31(55-34-13-12-29(52-10)27(6)54-34)40(56-30)42(8)15-14-32(57-42)41(7)16-17-44(61-41)20-28(46)24(3)37(59-44)25(4)38-39(53-11)35(49)26(5)45(51,60-38)21-33(47)48;/h22-32,34-40,46,49-51H,12-21H2,1-11H3,(H,47,48);/q;+1/p-1/t22-,23+,24+,25+,26-,27+,28-,29-,30+,31-,32+,34-,35-,36-,37-,38-,39+,40+,41-,42-,43-,44+,45+;/m0./s1

HIDE SMILES / InChI

Molecular Formula	Na
Molecular Weight	22.9898
Charge	1
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	C45H75O16
Molecular Weight	872.0674
Charge	-1
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	23 / 23
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:59:49 UTC 2023` Edited by `admin` on `Fri Dec 15 15:59:49 UTC 2023`
Record UNII	8B50X0IVEC
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

SEMDURAMICIN SODIUM

Official Name

English

(3R,4S,5S,6R,7S,22S)-23,27-Didemethoxy-2,6,22-tridemethyl-5,11-di-O-demethyl-6-methoxy-22-[[(2S,5S,6R)-tetrahydro-5-methoxy-6-methyl-2H-pyran-2-yl]oxy]lonomycin A, monosodium salt

Common Name

English

UK-61689-2

Code

English

SODIUM SEMDURAMICIN

Common Name

English

LONOMYCIN A, 23,27-DIDEMETHOXY-2,6,22-TRIDEMETHYL-5,11-DI-O-DEMETHYL-6-METHOXY-22-((TETRAHYDRO-5-METHOXY-6-METHYL-2H-PYRAN-2-YL)OXY)-, MONOSODIUM SALT, (3R,4S,5S,6R,7S,22S(2S,5S,6R))-

Common Name

English

SEMDURAMICIN SODIUM SALT [MI]

Common Name

English

SEMDURAMICIN SODIUM [USAN]

Common Name

English

SEMDURAMICIN SODIUM [GREEN BOOK]

Common Name

English

SEMDURAMICIN SODIUM [JAN]

Common Name

English

UK-61,689-2

Code

English

AVIAX

Brand Name

English

SEMDURAMICIN SODIUM SALT

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C277