ADENOMYCIN

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C25H39N7O18S
Molecular Weight	757.678
Optical Activity	UNSPECIFIED
Defined Stereocenters	16 / 16
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

N[C@@H](CO)C(=O)O[C@@H]1[C@@H](OC[C@H]2O[C@H]([C@H](O)[C@@H]2O)N3C=NC4=C3N=CN=C4N)[C@H](O)[C@H](O[C@H]5O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]5N)[C@@H](O)[C@H]1OS(O)(=O)=O

InChI

InChIKey=UXRHCHSWRDOIED-QVEOBRIHSA-N

InChI=1S/C25H39N7O18S/c26-6(1-33)24(41)48-20-18(45-3-8-12(36)14(38)23(46-8)32-5-31-10-21(28)29-4-30-22(10)32)15(39)17(16(40)19(20)50-51(42,43)44)49-25-9(27)13(37)11(35)7(2-34)47-25/h4-9,11-20,23,25,33-40H,1-3,26-27H2,(H2,28,29,30)(H,42,43,44)/t6-,7-,8+,9-,11+,12+,13+,14+,15+,16+,17-,18-,19+,20+,23+,25+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C25H39N7O18S
Molecular Weight	757.678
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	16 / 16
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 08:04:04 GMT 2025` Edited by `admin` on `Wed Apr 02 08:04:04 GMT 2025`
Record UNII	O4PL8DR3EV
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ADENOMYCIN

Common Name

English

NSC-336242

Preferred Name

English

L-SERINE, 4''-ESTER WITH O-2-AMINO-2-DEOXY-.BETA.-L-GULOPYRANOSYL-(1->1)-O-3-DEOXY-5-O-SULFO-L-CHIRO-INOSITOL-3-YL-(3->5')-ADENOSINE

Common Name

English

Adenomycin [WHO-DD]

Common Name

English

L-SERINE, 6-ESTER WITH 5'-O-((1S-(1.ALPHA.,2.BETA.,3.BETA.,4.ALPHA.,5.ALPHA.,6.BETA.))-3-((2-AMINO-2-DEOXY-.BETA.-L-GULOPYRANOSYL)OXY)-2,4,6-TRIHYDROXY-5-(SULFOOXY)CYCLOHEXYL)ADENOSINE

Systematic Name

English

Code System Code Type Description

NSC

336242

Created by admin on Wed Apr 02 08:04:04 GMT 2025 , Edited by admin on Wed Apr 02 08:04:04 GMT 2025

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CAS

76174-56-6

Created by admin on Wed Apr 02 08:04:04 GMT 2025 , Edited by admin on Wed Apr 02 08:04:04 GMT 2025

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FDA UNII

O4PL8DR3EV

Created by admin on Wed Apr 02 08:04:04 GMT 2025 , Edited by admin on Wed Apr 02 08:04:04 GMT 2025

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PUBCHEM

195904

Created by admin on Wed Apr 02 08:04:04 GMT 2025 , Edited by admin on Wed Apr 02 08:04:04 GMT 2025

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