BULGECIN A

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C16H29N3O14S2
Molecular Weight	551.543
Optical Activity	UNSPECIFIED
Defined Stereocenters	8 / 8
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC(=O)N[C@H]1[C@H](O)[C@@H](OS(O)(=O)=O)[C@@H](CO)O[C@H]1O[C@H]2C[C@@H](N[C@H]2CO)C(=O)NCCS(O)(=O)=O

InChI

InChIKey=RPNZWZDLNYCCIG-RWQOYFMZSA-N

InChI=1S/C16H29N3O14S2/c1-7(22)18-12-13(23)14(33-35(28,29)30)11(6-21)32-16(12)31-10-4-8(19-9(10)5-20)15(24)17-2-3-34(25,26)27/h8-14,16,19-21,23H,2-6H2,1H3,(H,17,24)(H,18,22)(H,25,26,27)(H,28,29,30)/t8-,9+,10+,11-,12+,13+,14+,16-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C16H29N3O14S2
Molecular Weight	551.543
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	8 / 8
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 18:18:14 UTC 2023` Edited by `admin` on `Sat Dec 16 18:18:14 UTC 2023`
Record UNII	DMF8MD9MYE
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

BULGECIN A

Common Name

English

Ethanesulfonic acid, 2-[[4-O-[2-(acetylamino)-2-deoxy-4-O-sulfo-β-D-glucopyranosyl]-2,3,5-trideoxy-2,5-imino-D-arabino-hexonoyl]amino]-

Systematic Name

English

Code System Code Type Description

PUBCHEM

46936433

Created by admin on Sat Dec 16 18:18:14 UTC 2023 , Edited by admin on Sat Dec 16 18:18:14 UTC 2023

PRIMARY

CAS

92953-54-3

Created by admin on Sat Dec 16 18:18:14 UTC 2023 , Edited by admin on Sat Dec 16 18:18:14 UTC 2023

PRIMARY

EPA CompTox

DTXSID90869108

Created by admin on Sat Dec 16 18:18:14 UTC 2023 , Edited by admin on Sat Dec 16 18:18:14 UTC 2023

PRIMARY

FDA UNII

DMF8MD9MYE

Created by admin on Sat Dec 16 18:18:14 UTC 2023 , Edited by admin on Sat Dec 16 18:18:14 UTC 2023

PRIMARY

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