POLYMYXIN D2

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C49H91N15O15
Molecular Weight	1130.3383
Optical Activity	UNSPECIFIED
Defined Stereocenters	13 / 13
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@](NC(=O)[C@H](CCN)NC(=O)CCCCC(C)C)([C@@H](C)O)C(=O)N[C@H](CO)C(=O)N[C@H]1CCNC(=O)[C@@]([H])(NC(=O)[C@H](CCN)NC(=O)[C@H](CCN)NC(=O)[C@@H](NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](CCN)NC1=O)[C@@H](C)O)[C@@H](C)O

InChI

InChIKey=AMOWTOQDROFIIR-ALESKEBOSA-N

InChI=1S/C49H91N15O15/c1-24(2)10-8-9-11-36(69)55-29(12-17-50)43(73)63-39(28(7)68)49(79)61-35(23-65)46(76)58-33-16-21-54-47(77)37(26(5)66)62-44(74)32(15-20-53)57-40(70)31(14-19-52)59-48(78)38(27(6)67)64-45(75)34(22-25(3)4)60-41(71)30(13-18-51)56-42(33)72/h24-35,37-39,65-68H,8-23,50-53H2,1-7H3,(H,54,77)(H,55,69)(H,56,72)(H,57,70)(H,58,76)(H,59,78)(H,60,71)(H,61,79)(H,62,74)(H,63,73)(H,64,75)/t26-,27-,28-,29+,30+,31+,32+,33+,34-,35-,37+,38+,39+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C49H91N15O15
Molecular Weight	1130.3383
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	13 / 13
E/Z Centers	3
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 09:52:49 GMT 2023` Edited by `admin` on `Sat Dec 16 09:52:49 GMT 2023`
Record UNII	921VYT3034
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

POLYMYXIN D2

Common Name

English

POLYMYXIN D2 [MI]

Common Name

English

L-THREONINE, (2S)-4-AMINO-2-((6-METHYL-1-OXOHEPTYL)AMINO)BUTANOYL-L-THREONYL-D-SERYL-(2S)-2,4-DIAMINOBUTANOYL-(2S)-2,4-DIAMINOBUTANOYL-D-LEUCYL-L-THREONYL-(2S)-2,4-DIAMINOBUTANOYL-(2S)-2,4-DIAMINOBUTANOYL-, (10->4)-LACTAM

Common Name

English

Code System Code Type Description

PUBCHEM

72710707

Created by admin on Sat Dec 16 09:52:49 GMT 2023 , Edited by admin on Sat Dec 16 09:52:49 GMT 2023

PRIMARY

CAS

34167-45-8

Created by admin on Sat Dec 16 09:52:49 GMT 2023 , Edited by admin on Sat Dec 16 09:52:49 GMT 2023

PRIMARY

MERCK INDEX

m8963

Created by admin on Sat Dec 16 09:52:49 GMT 2023 , Edited by admin on Sat Dec 16 09:52:49 GMT 2023

PRIMARY

Merck Index

FDA UNII

921VYT3034

Created by admin on Sat Dec 16 09:52:49 GMT 2023 , Edited by admin on Sat Dec 16 09:52:49 GMT 2023

PRIMARY