SAXITOXIN O-METHYLOXIME

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C11H18N8O3
Molecular Weight	310.3124
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CON=C1CCN2C(=N)N[C@@H](COC(N)=O)[C@@H]3NC(=N)N[C@]123

InChI

InChIKey=YPOVEGCBUQXQII-VBDPQCHBSA-N

InChI=1S/C11H18N8O3/c1-21-18-6-2-3-19-9(13)15-5(4-22-10(14)20)7-11(6,19)17-8(12)16-7/h5,7H,2-4H2,1H3,(H2,13,15)(H2,14,20)(H3,12,16,17)/b18-6+/t5-,7-,11+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C11H18N8O3
Molecular Weight	310.3124
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	3 / 3
E/Z Centers	1
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Tue Apr 01 22:04:33 GMT 2025` Edited by `admin` on `Tue Apr 01 22:04:33 GMT 2025`
Record UNII	54G6V2BGQ9
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

SAXITOXIN O-METHYLOXIME

Common Name

English

SAXITOXIN METHYLOXIME

Preferred Name

English

1H,10H-PYRROLO(1,2-C)PURIN-10-ONE, 2,6-DIAMINO-4-(((AMINOCARBONYL)OXY)METHYL)-3A,4,8,9-TETRAHYDRO-, O-METHYLOXIME, (3AS-(3A.ALPHA.,4.ALPHA.,10AR*))-

Systematic Name

English

Code System Code Type Description

CAS

108045-00-7

Created by admin on Tue Apr 01 22:04:33 GMT 2025 , Edited by admin on Tue Apr 01 22:04:33 GMT 2025

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PUBCHEM

135565611

Created by admin on Tue Apr 01 22:04:33 GMT 2025 , Edited by admin on Tue Apr 01 22:04:33 GMT 2025

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FDA UNII

54G6V2BGQ9

Created by admin on Tue Apr 01 22:04:33 GMT 2025 , Edited by admin on Tue Apr 01 22:04:33 GMT 2025

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