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Details

Stereochemistry ABSOLUTE
Molecular Formula C27H45NO7.ClH
Molecular Weight 532.11
Optical Activity UNSPECIFIED
Defined Stereocenters 13 / 13
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of LNF-209

SMILES

Cl.[H][C@@]5(O[C@H]1CC[C@@]2(C)[C@]([H])(CC[C@]3([H])[C@]2([H])CC[C@]4(C)[C@H](CC[C@]34N)C(=O)OC)C1)O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O

InChI

InChIKey=XIKOUXLAXLNRBF-UAKODCJFSA-N
InChI=1S/C27H45NO7.ClH/c1-14-20(29)21(30)22(31)24(34-14)35-16-7-10-25(2)15(13-16)5-6-18-17(25)8-11-26(3)19(23(32)33-4)9-12-27(18,26)28;/h14-22,24,29-31H,5-13,28H2,1-4H3;1H/t14-,15+,16-,17-,18+,19+,20-,21+,22+,24-,25-,26+,27-;/m0./s1

HIDE SMILES / InChI

Molecular Formula C27H45NO7
Molecular Weight 495.6487
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 13 / 13
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:39:42 GMT 2023
Edited
by admin
on Fri Dec 15 15:39:42 GMT 2023
Record UNII
V1XK2W4T08
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
LNF-209
Code English
ANDROSTANE-17-CARBOXYLIC ACID, 14-AMINO-3-((6-DEOXY-.ALPHA.-L-MANNOPYRANOSYL)OXY)-, METHYL ESTER, HYDROCHLORIDE, (3.BETA.,5.BETA.,14.BETA.,17.BETA.)-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID10932464
Created by admin on Fri Dec 15 15:39:42 GMT 2023 , Edited by admin on Fri Dec 15 15:39:42 GMT 2023
PRIMARY
CAS
144979-06-6
Created by admin on Fri Dec 15 15:39:42 GMT 2023 , Edited by admin on Fri Dec 15 15:39:42 GMT 2023
PRIMARY
PUBCHEM
131842228
Created by admin on Fri Dec 15 15:39:42 GMT 2023 , Edited by admin on Fri Dec 15 15:39:42 GMT 2023
PRIMARY
FDA UNII
V1XK2W4T08
Created by admin on Fri Dec 15 15:39:42 GMT 2023 , Edited by admin on Fri Dec 15 15:39:42 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE