Auristatin F

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C40H67N5O8
Molecular Weight	745.9887
Optical Activity	UNSPECIFIED
Defined Stereocenters	9 / 9
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC[C@H](C)[C@@H]([C@@H](CC(=O)N1CCC[C@H]1[C@H](OC)[C@@H](C)C(=O)N[C@@H](CC2=CC=CC=C2)C(O)=O)OC)N(C)C(=O)[C@@H](NC(=O)[C@H](C(C)C)N(C)C)C(C)C

InChI

InChIKey=LGNCNVVZCUVPOT-FUVGGWJZSA-N

InChI=1S/C40H67N5O8/c1-13-26(6)35(44(10)39(49)33(24(2)3)42-38(48)34(25(4)5)43(8)9)31(52-11)23-32(46)45-21-17-20-30(45)36(53-12)27(7)37(47)41-29(40(50)51)22-28-18-15-14-16-19-28/h14-16,18-19,24-27,29-31,33-36H,13,17,20-23H2,1-12H3,(H,41,47)(H,42,48)(H,50,51)/t26-,27+,29-,30-,31+,33-,34-,35-,36+/m0/s1

HIDE SMILES / InChI

Approval Year

Targets

Primary Target	Pharmacology	Condition	Potency
microtubule 3 Target ID: GO:0005874 Sources: https://www.ncbi.nlm.nih.gov/pubmed/27518442\|https://www.ncbi.nlm.nih.gov/pubmed/26660762	Inhibitor 8504

Name

Type

Language

L-Phenylalanine, N,N-dimethyl-L-valyl-L-valyl-(3R,4S,5S)-3-methoxy-5-methyl-4-(methylamino)heptanoyl-(?R,?R,2S)-?-methoxy-?-methyl-2-pyrrolidinepropanoyl-

Preferred Name

English

Auristatin F

Common Name

English

N,N-Dimethyl-L-valyl-L-valyl-(3R,4S,5S)-3-methoxy-5-methyl-4-(methylamino)heptanoyl-(?R,?R,2S)-?-methoxy-?-methyl-2-pyrrolidinepropanoyl-L-phenylalanine

Common Name

English

Code System Code Type Description

PUBCHEM

67472795

Created by admin on Wed Apr 02 21:25:30 GMT 2025 , Edited by admin on Wed Apr 02 21:25:30 GMT 2025

PRIMARY

FDA UNII

VG7S7JRA56

Created by admin on Wed Apr 02 21:25:30 GMT 2025 , Edited by admin on Wed Apr 02 21:25:30 GMT 2025

PRIMARY

CAS

163768-50-1

Created by admin on Wed Apr 02 21:25:30 GMT 2025 , Edited by admin on Wed Apr 02 21:25:30 GMT 2025

PRIMARY

SUBSTANCE RECORD


					VG7S7JRA56

Auristatin F