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Details

Stereochemistry ABSOLUTE
Molecular Formula C40H55N3O10Si
Molecular Weight 765.9643
Optical Activity ( + )
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-Propen-1-yl (1R,2R,4R,5S)-4-cyano-2-[[[(1,1-dimethylethyl)dimethylsilyl]oxy]methyl]-1,2,3,4,5,6-hexahydro-3-[(1R)-2-hydroxy-1-[6-(methoxymethoxy)-7-methyl-1,3-benzodioxol-4-yl]ethyl]-9-methoxy-8-methyl-10-(2-propen-1-yloxy)-1,5-imino-3-benzazocine-11-c

SMILES

COCOC1=CC([C@H](CO)N2[C@@H](CO[Si](C)(C)C(C)(C)C)[C@@H]3N([C@@H](CC4=CC(C)=C(OC)C(OCC=C)=C34)[C@@H]2C#N)C(=O)OCC=C)=C5OCOC5=C1C

InChI

InChIKey=NKHDCZUEEQLDMU-FDINXRQASA-N
InChI=1S/C40H55N3O10Si/c1-12-14-48-38-33-26(16-24(3)35(38)47-9)17-28-29(19-41)42(30(20-44)27-18-32(50-22-46-8)25(4)36-37(27)52-23-51-36)31(21-53-54(10,11)40(5,6)7)34(33)43(28)39(45)49-15-13-2/h12-13,16,18,28-31,34,44H,1-2,14-15,17,20-23H2,3-11H3/t28-,29-,30-,31-,34-/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
1,5-Imino-3-benzazocine-11-carboxylic acid, 4-cyano-2-[[[(1,1-dimethylethyl)dimethylsilyl]oxy]methyl]-1,2,3,4,5,6-hexahydro-3-[(1R)-2-hydroxy-1-[6-(methoxymethoxy)-7-methyl-1,3-benzodioxol-4-yl]ethyl]-9-methoxy-8-methyl-10-(2-propen-1-yloxy)-, 2-propen-1
Preferred Name English
2-Propen-1-yl (1R,2R,4R,5S)-4-cyano-2-[[[(1,1-dimethylethyl)dimethylsilyl]oxy]methyl]-1,2,3,4,5,6-hexahydro-3-[(1R)-2-hydroxy-1-[6-(methoxymethoxy)-7-methyl-1,3-benzodioxol-4-yl]ethyl]-9-methoxy-8-methyl-10-(2-propen-1-yloxy)-1,5-imino-3-benzazocine-11-c
Systematic Name English
Code System Code Type Description
FDA UNII
5F8HQA3VW3
Created by admin on Wed Apr 02 20:25:05 GMT 2025 , Edited by admin on Wed Apr 02 20:25:05 GMT 2025
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PUBCHEM
129626460
Created by admin on Wed Apr 02 20:25:05 GMT 2025 , Edited by admin on Wed Apr 02 20:25:05 GMT 2025
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CAS
874758-76-6
Created by admin on Wed Apr 02 20:25:05 GMT 2025 , Edited by admin on Wed Apr 02 20:25:05 GMT 2025
PRIMARY