THURINGIENSIN

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C22H32N5O19P
Molecular Weight	701.4853
Optical Activity	UNSPECIFIED
Defined Stereocenters	13 / 13
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

NC1=NC=NC2=C1N=CN2[C@@H]3O[C@H](CO[C@@H]4[C@@H](CO)O[C@H](O[C@H]([C@H](O)[C@H](OP(O)(O)=O)[C@H](O)C(O)=O)C(O)=O)[C@H](O)[C@H]4O)[C@@H](O)[C@H]3O

InChI

InChIKey=OTLLEIBWKHEHGU-TUNUFRSWSA-N

InChI=1S/C22H32N5O19P/c23-17-7-18(25-3-24-17)27(4-26-7)19-10(31)8(29)6(43-19)2-42-14-5(1-28)44-22(11(32)9(14)30)45-16(21(37)38)12(33)15(13(34)20(35)36)46-47(39,40)41/h3-6,8-16,19,22,28-34H,1-2H2,(H,35,36)(H,37,38)(H2,23,24,25)(H2,39,40,41)/t5-,6-,8-,9-,10-,11-,12-,13+,14-,15+,16-,19-,22-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C22H32N5O19P
Molecular Weight	701.4853
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	13 / 13
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

PubMed

Title	Date	PubMed
[Exotoxin-induced polyneuropathies].	1975-04-25	806179

Patents

Substance Class	Chemical Created by `admin` on `Mon Mar 31 21:59:49 GMT 2025` Edited by `admin` on `Mon Mar 31 21:59:49 GMT 2025`
Record UNII	JBU770V87C
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

THURINGIENSIN

Common Name

English

THURINTOX

Preferred Name

English

.BETA.-EXOTOXIN (BACILLUS THURINGIENSIS)

Common Name

English

D-ALLARIC ACID, O-5'-DEOXYADENOSIN-5'-YL-(5'->4)-O-.ALPHA.-D-GLUCOPYRANOSYL-(1->2)-, 4-(DIHYDROGEN PHOSPHATE

Systematic Name

English

THURINGIENSIN A

Common Name

English

NSC-197177

Code

English

Code System Code Type Description

CAS

23526-02-5