L-756423 SULFATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C39H48N4O5.H2O4S
Molecular Weight	750.901
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OS(O)(=O)=O.CC(C)(C)NC(=O)[C@@H]1CN(CC2=CC3=C(O2)C=CC=C3)CCN1C[C@@H](O)C[C@@H](CC4=CC=CC=C4)C(=O)N[C@@H]5[C@H](O)CC6=C5C=CC=C6

InChI

InChIKey=UWYBCVUVANCOEX-DOKCPVFOSA-N

InChI=1S/C39H48N4O5.H2O4S/c1-39(2,3)41-38(47)33-25-42(24-31-21-28-14-8-10-16-35(28)48-31)17-18-43(33)23-30(44)20-29(19-26-11-5-4-6-12-26)37(46)40-36-32-15-9-7-13-27(32)22-34(36)45;1-5(2,3)4/h4-16,21,29-30,33-34,36,44-45H,17-20,22-25H2,1-3H3,(H,40,46)(H,41,47);(H2,1,2,3,4)/t29-,30+,33+,34-,36+;/m1./s1

HIDE SMILES / InChI

Molecular Formula	H2O4S
Molecular Weight	98.078
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	C39H48N4O5
Molecular Weight	652.8222
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	5 / 5
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:51:45 UTC 2023` Edited by `admin` on `Fri Dec 15 15:51:45 UTC 2023`
Record UNII	83N3N6B9U8
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

L-756423 SULFATE

Code

English

D-ERYTHRO-PENTONAMIDE, 5-((2S)-4-(2-BENZOFURANYLMETHYL)-2-(((1,1-DIMETHYLETHYL)AMINO)CARBONYL)-1-PIPERAZINYL)-2,3,5-TRIDEOXY-N-((1S,2R)-2,3-DIHYDRO-2-HYDROXY-1H-INDEN-1-YL)-2-(PHENYLMETHYL)-, SULFATE (1:1) (SALT)

Common Name

English

N-(2(R)-HYDROXY-1(S)-INDANYL)-2(R)-PHENYLMETHYL-4(S)-HYDROXY-5-(1-(4-(2-BENZO(B)FURANYLMETHYL)-2(S)-N'-(T-BUTYL-CARBOXAMIDO)-PIPERAZINYL))-PENTANEAMIDE SULFATE

Common Name

English

Code System Code Type Description

FDA UNII

83N3N6B9U8

Created by admin on Fri Dec 15 15:51:45 UTC 2023 , Edited by admin on Fri Dec 15 15:51:45 UTC 2023

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PUBCHEM

9831957

Created by admin on Fri Dec 15 15:51:45 UTC 2023 , Edited by admin on Fri Dec 15 15:51:45 UTC 2023

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CAS

216863-67-1

Created by admin on Fri Dec 15 15:51:45 UTC 2023 , Edited by admin on Fri Dec 15 15:51:45 UTC 2023

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