APD-209

Investigational

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C54H95N3O16
Molecular Weight	1042.3426
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 6
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CCCCCCCCCCCCC#CC#CCCCCCCCCC(=O)NCCOCCOCCOCCOCCOCCC(=O)NCCCCCO[C@@]1(C[C@H](O)[C@@H](NC(C)=O)[C@@H](O1)[C@H](O)[C@H](O)CO)C(O)=O

InChI

InChIKey=VRJMVFQLUBTBKF-HBJHFNNESA-N

InChI=1S/C54H95N3O16/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-25-28-48(62)56-31-34-68-36-38-70-40-42-71-41-39-69-37-35-67-33-29-49(63)55-30-26-24-27-32-72-54(53(65)66)43-46(60)50(57-45(2)59)52(73-54)51(64)47(61)44-58/h46-47,50-52,58,60-61,64H,3-13,18-44H2,1-2H3,(H,55,63)(H,56,62)(H,57,59)(H,65,66)/t46-,47+,50+,51+,52+,54+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C54H95N3O16
Molecular Weight	1042.3426
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	6 / 6
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Tue Apr 01 22:03:39 GMT 2025` Edited by `admin` on `Tue Apr 01 22:03:39 GMT 2025`
Record UNII	VBU6DO3S24
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

APD-209

Code

English

.ALPHA.-NEURAMINIC ACID, N-ACETYL-2-O-(7,26-DIOXO-10,13,16,19,22-PENTAOXA-6,25-DIAZAPENTACONTA-35,37-DIYN-1-YL)-

Preferred Name

English

Code System Code Type Description

FDA UNII

VBU6DO3S24

Created by admin on Tue Apr 01 22:03:39 GMT 2025 , Edited by admin on Tue Apr 01 22:03:39 GMT 2025

PRIMARY

CAS

1261156-82-4

Created by admin on Tue Apr 01 22:03:39 GMT 2025 , Edited by admin on Tue Apr 01 22:03:39 GMT 2025

PRIMARY

PUBCHEM

49837938

Created by admin on Tue Apr 01 22:03:39 GMT 2025 , Edited by admin on Tue Apr 01 22:03:39 GMT 2025

PRIMARY

CAS

1333495-72-9

Created by admin on Tue Apr 01 22:03:39 GMT 2025 , Edited by admin on Tue Apr 01 22:03:39 GMT 2025

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