Vodudeutentan sodium

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C34H50N5O7.Na
Molecular Weight	665.7922
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[Na+].[2H]C[C@H]1CCC[C@@H](C[2H])N1C(=O)N[C@@H](CC(C)(C)C)C(=O)N[C@H](CC2=CN(C(=O)OC)C3=C2C=CC=C3)C(=O)N[C@H](CCCC)C([O-])=O

InChI

InChIKey=QCVIFBRTTLMEOV-ZOHSNMQTSA-M

InChI=1S/C34H51N5O7.Na/c1-8-9-16-25(31(42)43)35-29(40)26(18-23-20-38(33(45)46-7)28-17-11-10-15-24(23)28)36-30(41)27(19-34(4,5)6)37-32(44)39-21(2)13-12-14-22(39)3;/h10-11,15,17,20-22,25-27H,8-9,12-14,16,18-19H2,1-7H3,(H,35,40)(H,36,41)(H,37,44)(H,42,43);/q;+1/p-1/t21-,22+,25-,26-,27+;/m1./s1/i2D,3D;

HIDE SMILES / InChI

Molecular Formula	Na
Molecular Weight	22.9898
Charge	1
Count

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

Molecular Formula	C34H51N5O7
Molecular Weight	643.8104
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 `Sat Dec 16 15:34:39 UTC 2023` Edited by `admin` on `Sat Dec 16 15:34:39 UTC 2023`
Record UNII	AAY8R26VDX
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Vodudeutentan sodium

Common Name

English

ENB-003

Code

English

ENB 003 [WHO-DD]

Common Name

English

D-NORLEUCINE, N-((CIS-2,6-DI(METHYL-D)-1-PIPERIDINYL)CARBONYL)-4-METHYL-L-LEUCYL-1-(METHOXYCARBONYL)-D-TRYPTOPHYL-, Sodium salt

Systematic Name

English

BQ-788, DI(METHYL-D)-

Code

English

ENB003

Code

English

Classification Tree Code System Code

FDA ORPHAN DRUG

679519