.ALPHA.-SAXITOXINOL

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C10H17N7O3
Molecular Weight	283.2871
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12N=C(N)N[C@@]13[C@H](O)CCN3C(N)=N[C@H]2COC(N)=O

InChI

InChIKey=NILHUXIFTLLDPJ-LKCKTBJASA-N

InChI=1S/C10H17N7O3/c11-7-15-6-4(3-20-9(13)19)14-8(12)17-2-1-5(18)10(6,17)16-7/h4-6,18H,1-3H2,(H2,12,14)(H2,13,19)(H3,11,15,16)/t4-,5+,6-,10+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C10H17N7O3
Molecular Weight	283.2871
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	4 / 4
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 09:55:54 GMT 2023` Edited by `admin` on `Sat Dec 16 09:55:54 GMT 2023`
Record UNII	3P2YEH7QBV
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

.ALPHA.-SAXITOXINOL

Common Name

English

SAXITOXINOL

Common Name

English

1H,8H-PYRROLO(1,2-C)PURINE-4-METHANOL, 2,6-DIAMINO-3A,4,9,10-TETRAHYDRO-10-HYDROXY-, 4-CARBAMATE, (3AS,4R,10R,10AS)-

Systematic Name

English

((3AS,4R,10R,10AS)-2,6-DIAMINO-10-HYDROXY-1,3A,4,8,9,10-HEXAHYDROPYRROLO(1,2-C)PURIN-4-YL)METHYL CARBAMATE

Systematic Name

English

1H,8H-PYRROLO(1,2-C)PURINE-4-METHANOL, 2,6-DIAMINO-3A,4,9,10-TETRAHYDRO-10-HYDROXY-, .ALPHA.-CARBAMATE, (3AS-(3A.ALPHA.,4.ALPHA.,10.BETA.,10AR*))-

Systematic Name

English

ALPHA-SAXITOXINOL

Common Name

English

DIHYDROSAXITOXIN

Common Name

English

.ALPHA.-DIHYDROSAXITOXIN

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID70678553

Created by admin on Sat Dec 16 09:55:54 GMT 2023 , Edited by admin on Sat Dec 16 09:55:54 GMT 2023

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PUBCHEM

101712120

Created by admin on Sat Dec 16 09:55:54 GMT 2023 , Edited by admin on Sat Dec 16 09:55:54 GMT 2023

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FDA UNII

3P2YEH7QBV

Created by admin on Sat Dec 16 09:55:54 GMT 2023 , Edited by admin on Sat Dec 16 09:55:54 GMT 2023

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CAS

75420-34-7

Created by admin on Sat Dec 16 09:55:54 GMT 2023 , Edited by admin on Sat Dec 16 09:55:54 GMT 2023

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