ETIDALIGIDE ADENINE(32) 3'-MODIFICATION

Details

Stereochemistry	EPIMERIC
Molecular Formula	C38H63N8O21P3
Molecular Weight	1060.8691
Optical Activity	UNSPECIFIED
Defined Stereocenters	7 / 8
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ETIDALIGIDE ADENINE(32) 3'-MODIFICATION

Structure Search

SMILES

CO[C@@H]1[C@H](OP(O)(=O)OCC(O)COCCCNC(=O)CCCCCCCCCCOP(O)(=O)OC[C@H]2O[C@H](C[C@@H]2O)N3C=C(C)C(=O)NC3=O)[C@@H](COP(O)(O)=O)O[C@H]1N4C=NC5=C4N=CN=C5N

InChI

InChIKey=TZFFLKPTXNIARH-OIRZZQJWSA-N

InChI=1S/C38H63N8O21P3/c1-24-17-45(38(51)44-36(24)50)30-16-26(48)27(65-30)20-64-69(55,56)61-15-10-8-6-4-3-5-7-9-12-29(49)40-13-11-14-60-18-25(47)19-63-70(57,58)67-32-28(21-62-68(52,53)54)66-37(33(32)59-2)46-23-43-31-34(39)41-22-42-35(31)46/h17,22-23,25-28,30,32-33,37,47-48H,3-16,18-21H2,1-2H3,(H,40,49)(H,55,56)(H,57,58)(H2,39,41,42)(H,44,50,51)(H2,52,53,54)/t25?,26-,27+,28+,30+,32+,33+,37+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C38H63N8O21P3
Molecular Weight	1060.8691
Charge	0
Count

Stereochemistry	EPIMERIC
Additional Stereochemistry	No
Defined Stereocenters	7 / 8
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Tue Apr 01 22:57:04 GMT 2025` Edited by `admin` on `Tue Apr 01 22:57:04 GMT 2025`
Record UNII	64G05FP5JN
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ETIDALIGIDE ADENINE(32) 3'-MODIFICATION

Common Name

English

ETIDALIGIDE THYMINE(1) 5'-MODIFICATION

Preferred Name

English

Code System Code Type Description

FDA UNII

64G05FP5JN

Created by admin on Tue Apr 01 22:57:04 GMT 2025 , Edited by admin on Tue Apr 01 22:57:04 GMT 2025

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PUBCHEM

165411954

Created by admin on Tue Apr 01 22:57:04 GMT 2025 , Edited by admin on Tue Apr 01 22:57:04 GMT 2025

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