BETA-S-ARCA (D1)

Details

Stereochemistry	EPIMERIC
Molecular Formula	C22H31N10O17P3S
Molecular Weight	832.525
Optical Activity	UNSPECIFIED
Defined Stereocenters	8 / 8
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CO[C@@H]1[C@H](O)[C@@H](COP([O-])(=O)OP(S)(=O)OP(O)(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2O)N3C=NC4=C3N=C(N)NC4=O)O[C@H]1N5C=[N+](C)C6=C5N=C(N)NC6=O

InChI

InChIKey=DOOBEITVZIIXPE-XJGHKLLTSA-N

InChI=1S/C22H31N10O17P3S/c1-30-6-32(16-10(30)18(37)29-22(24)27-16)20-14(43-2)12(34)8(47-20)4-45-51(40,41)49-52(42,53)48-50(38,39)44-3-7-11(33)13(35)19(46-7)31-5-25-9-15(31)26-21(23)28-17(9)36/h5-8,11-14,19-20,33-35H,3-4H2,1-2H3,(H8-,23,24,26,27,28,29,36,37,38,39,40,41,42,53)/t7-,8-,11-,12-,13-,14-,19-,20-,52?/m1/s1

HIDE SMILES / InChI

Molecular Formula	C22H31N10O17P3S
Molecular Weight	832.525
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 16:11:05 GMT 2023` Edited by `admin` on `Sat Dec 16 16:11:05 GMT 2023`
Record UNII	N9Y6S0ZG5C
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

BETA-S-ARCA (D1)

Common Name

English

5'-GUANYLIC ACID, 7-METHYL-2'-O-METHYL-, INNER SALT, P'-ANHYDRIDE WITH 5'-GUANYLIC ACID MONOANHYDRIDE WITH PHOSPHOROTHIOIC ACID

Common Name

English

Code System Code Type Description

FDA UNII

N9Y6S0ZG5C

Created by admin on Sat Dec 16 16:11:05 GMT 2023 , Edited by admin on Sat Dec 16 16:11:05 GMT 2023

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CAS

1093268-63-3

Created by admin on Sat Dec 16 16:11:05 GMT 2023 , Edited by admin on Sat Dec 16 16:11:05 GMT 2023

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PUBCHEM

155491055

Created by admin on Sat Dec 16 16:11:05 GMT 2023 , Edited by admin on Sat Dec 16 16:11:05 GMT 2023

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