BUTIROSIN A DISULFATE ANHYDROUS

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C21H41N5O12.2H2O4S
Molecular Weight	751.734
Optical Activity	UNSPECIFIED
Defined Stereocenters	15 / 15
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of BUTIROSIN A DISULFATE ANHYDROUS

Structure Search

SMILES

OS(O)(=O)=O.OS(O)(=O)=O.[H][C@@]3(O[C@@H]1[C@@H](O)[C@@H](C[C@H](N)[C@H]1O[C@@]2([H])O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)NC(=O)[C@@H](O)CCN)O[C@H](CO)[C@H](O)[C@H]3O

InChI

InChIKey=JBEJXNWZBGTDKN-AUJNWUOJSA-N

InChI=1S/C21H41N5O12.2H2O4S/c22-2-1-8(28)19(34)26-7-3-6(24)17(37-20-11(25)15(32)13(30)9(4-23)35-20)18(12(7)29)38-21-16(33)14(31)10(5-27)36-21;2*1-5(2,3)4/h6-18,20-21,27-33H,1-5,22-25H2,(H,26,34);2*(H2,1,2,3,4)/t6-,7+,8-,9+,10+,11+,12-,13+,14-,15+,16+,17+,18+,20+,21-;;/m0../s1

HIDE SMILES / InChI

Molecular Formula	H2O4S
Molecular Weight	98.078
Charge	0
Count

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

Molecular Formula	C21H41N5O12
Molecular Weight	555.5765
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	15 / 15
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 10:01:36 GMT 2023` Edited by `admin` on `Sat Dec 16 10:01:36 GMT 2023`
Record UNII	9O03OE6Z07
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

BUTIROSIN A DISULFATE ANHYDROUS

Common Name

English

STREPTAMINE, O-2,6-DIAMINO-2,6-DIDEOXY-.ALPHA.-D-GLUCOPYRANOSYL-(1->4)-O-(.BETA.-D-XYLOFURANOSYL-(1->5))-N1-((2S)-4-AMINO-2-HYDROXY-1-OXOBUTYL)-2-DEOXY-, SULFATE (1:2) (SALT)

Systematic Name

English

NSC-175397

Code

English

BUTIROSIN A DISULFATE

Common Name

English

STREPTAMINE, O-2,6-DIAMINO-2,6-DIDEOXY-.ALPHA.-D-GLUCOPYRANOSYL-(1->4)-O-(.BETA.-D-XYLOFURANOSYL-(1->5))-N1-(4-AMINO-2-HYDROXY-1-OXOBUTYL)-2-DEOXY-, (S), SULFATE (1:2) (SALT)

Systematic Name

English

Code System Code Type Description

PUBCHEM

86278187