4-((O-6-O-PHOSPHONO-D-MANNO-D-MANNO-D-MANNO-6-O-PHOSPHONO-D-MANNO-D-MANNO-D-MANNO)OXY)BUTANOIC ACID 2-(2-(AMINOOXY)ACETYL)HYDRAZIDE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C42H75N3O40P2
Molecular Weight	1323.9885
Optical Activity	UNSPECIFIED
Defined Stereocenters	30 / 30
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4-((O-6-O-PHOSPHONO-D-MANNO-D-MANNO-D-MANNO-6-O-PHOSPHONO-D-MANNO-D-MANNO-D-MANNO)OXY)BUTANOIC ACID 2-(2-(AMINOOXY)ACETYL)HYDRAZIDE

Structure Search

SMILES

NOCC(=O)NNC(=O)CCCO[C@@H]1O[C@H](CO[C@H]2O[C@H](CO[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O[C@H]4O[C@H](COP(O)(O)=O)[C@@H](O)[C@H](O)[C@@H]4O)[C@@H](O)[C@H](O)[C@@H]2O)[C@@H](O)[C@H](O[C@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]5O[C@H]6O[C@H](COP(O)(O)=O)[C@@H](O)[C@H](O)[C@@H]6O)[C@@H]1O

InChI

InChIKey=WIGCRZTZOMDRLN-OMOUYTHNSA-N

InChI=1S/C42H75N3O40P2/c43-74-10-18(49)45-44-17(48)2-1-3-71-38-33(64)34(83-42-36(29(60)20(51)12(5-47)78-42)85-40-32(63)27(58)23(54)16(82-40)9-76-87(68,69)70)24(55)14(80-38)7-72-37-30(61)25(56)21(52)13(79-37)6-73-41-35(28(59)19(50)11(4-46)77-41)84-39-31(62)26(57)22(53)15(81-39)8-75-86(65,66)67/h11-16,19-42,46-47,50-64H,1-10,43H2,(H,44,48)(H,45,49)(H2,65,66,67)(H2,68,69,70)/t11-,12-,13-,14-,15-,16-,19-,20-,21-,22-,23-,24-,25+,26+,27+,28+,29+,30+,31+,32+,33+,34+,35+,36+,37+,38-,39-,40-,41+,42-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C42H75N3O40P2
Molecular Weight	1323.9885
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	30 / 30
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 14:44:35 GMT 2023` Edited by `admin` on `Sat Dec 16 14:44:35 GMT 2023`
Record UNII	DJ2K5G8Q34
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

4-((O-6-O-PHOSPHONO-D-MANNO-D-MANNO-D-MANNO-6-O-PHOSPHONO-D-MANNO-D-MANNO-D-MANNO)OXY)BUTANOIC ACID 2-(2-(AMINOOXY)ACETYL)HYDRAZIDE

Common Name

English

BUTANOIC ACID, 4-((O-6-O-PHOSPHONO-.ALPHA.-D-MANNOPYRANOSYL-(1->2)-O-.ALPHA.-D-MANNOPYRANOSYL-(1->6)-O-.ALPHA.-D-MANNOPYRANOSYL-(1->6)-O-(6-O-PHOSPHONO-.ALPHA.-D-MANNOPYRANOSYL-(1->2)-O-.ALPHA.-D-MANNOPYRANOSYL-(1->3))-.BETA.-D-MANNOPYRANOSYL)OXY)-, 2-(2

Systematic Name

English

Code System Code Type Description

FDA UNII

DJ2K5G8Q34

Created by admin on Sat Dec 16 14:44:35 GMT 2023 , Edited by admin on Sat Dec 16 14:44:35 GMT 2023

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CAS

1040259-08-2

Created by admin on Sat Dec 16 14:44:35 GMT 2023 , Edited by admin on Sat Dec 16 14:44:35 GMT 2023

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PUBCHEM

24999017

Created by admin on Sat Dec 16 14:44:35 GMT 2023 , Edited by admin on Sat Dec 16 14:44:35 GMT 2023

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