L-THREO-.ALPHA.-D-GALACTO-OCTOPYRANOSIDE, METHYL 7-CHLORO-6,7,8-TRIDEOXY-3,4-O-(1-METHYLETHYLIDENE)-6-((((2S,4R)-1-METHYL-4-PROPYL-2-PYRROLIDINYL)CARBONYL)AMINO)-1-THIO-, 2-HEXADECANOATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C37H67ClN2O6S
Molecular Weight	703.456
Optical Activity	UNSPECIFIED
Defined Stereocenters	9 / 9
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of L-THREO-.ALPHA.-D-GALACTO-OCTOPYRANOSIDE, METHYL 7-CHLORO-6,7,8-TRIDEOXY-3,4-O-(1-METHYLETHYLIDENE)-6-((((2S,4R)-1-METHYL-4-PROPYL-2-PYRROLIDINYL)CARBONYL)AMINO)-1-THIO-, 2-HEXADECANOATE

Structure Search

SMILES

[H][C@@](NC(=O)[C@@H]1C[C@@H](CCC)CN1C)([C@H](C)Cl)[C@@]2([H])O[C@H](SC)[C@H](OC(=O)CCCCCCCCCCCCCCC)[C@@]3([H])OC(C)(C)O[C@@]23[H]

InChI

InChIKey=WIDBPDXZLVYOBO-AKVWGGOBSA-N

InChI=1S/C37H67ClN2O6S/c1-8-10-11-12-13-14-15-16-17-18-19-20-21-23-29(41)43-34-33-32(45-37(4,5)46-33)31(44-36(34)47-7)30(26(3)38)39-35(42)28-24-27(22-9-2)25-40(28)6/h26-28,30-34,36H,8-25H2,1-7H3,(H,39,42)/t26-,27+,28-,30+,31+,32-,33-,34+,36+/m0/s1

HIDE SMILES / InChI

Approval Year

Name

Type

Language

L-THREO-.ALPHA.-D-GALACTO-OCTOPYRANOSIDE, METHYL 7-CHLORO-6,7,8-TRIDEOXY-3,4-O-(1-METHYLETHYLIDENE)-6-((((2S,4R)-1-METHYL-4-PROPYL-2-PYRROLIDINYL)CARBONYL)AMINO)-1-THIO-, 2-HEXADECANOATE

Systematic Name

English

Code System Code Type Description

FDA UNII

635KF5P2JS

Created by admin on Sat Dec 16 11:09:24 UTC 2023 , Edited by admin on Sat Dec 16 11:09:24 UTC 2023

PRIMARY

PUBCHEM

156614157

Created by admin on Sat Dec 16 11:09:24 UTC 2023 , Edited by admin on Sat Dec 16 11:09:24 UTC 2023

PRIMARY

CAS

906126-31-6

Created by admin on Sat Dec 16 11:09:24 UTC 2023 , Edited by admin on Sat Dec 16 11:09:24 UTC 2023

PRIMARY

SUBSTANCE RECORD


					635KF5P2JS

L-THREO-.ALPHA.-D-GALACTO-OCTOPYRANOSIDE, METHYL 7-CHLORO-6,7,8-TRIDEOXY-3,4-O-(1-METHYLETHYLIDENE)-6-((((2S,4R)-1-METHYL-4-PROPYL-2-PYRROLIDINYL)CARBONYL)AMINO)-1-THIO-, 2-HEXADECANOATE