DEMETHYLDOLASTATIN 10

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C41H66N6O6S
Molecular Weight	771.064
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)C3=NC=CS3)OC)N(C)C(=O)[C@@H](NC(=O)[C@@H](NC)C(C)C)C(C)C

InChI

InChIKey=BLUGYPPOFIHFJS-UUFHNPECSA-N

InChI=1S/C41H66N6O6S/c1-12-27(6)36(46(9)41(51)35(26(4)5)45-39(50)34(42-8)25(2)3)32(52-10)24-33(48)47-21-16-19-31(47)37(53-11)28(7)38(49)44-30(40-43-20-22-54-40)23-29-17-14-13-15-18-29/h13-15,17-18,20,22,25-28,30-32,34-37,42H,12,16,19,21,23-24H2,1-11H3,(H,44,49)(H,45,50)/t27-,28+,30-,31-,32+,34-,35-,36-,37+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C41H66N6O6S
Molecular Weight	771.064
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	9 / 9
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Targets

Primary Target	Pharmacology	Condition	Potency
Tubulin 69 Target ID: CHEMBL2095182 Sources: https://www.ncbi.nlm.nih.gov/pubmed/26791893	Inhibitor 8504

Substance Class	Chemical Created by `admin` on `Tue Apr 01 22:59:43 GMT 2025` Edited by `admin` on `Tue Apr 01 22:59:43 GMT 2025`
Record UNII	W4ZIA40FZ9
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

MONOMETHYLAURISTATIN D

Preferred Name

English

DEMETHYLDOLASTATIN 10

Common Name

English

N-METHYL-L-VALYL-N-((1S,2R)-2-METHOXY-4-((2S)-2-((1R,2R)-1-METHOXY-2-METHYL-3-OXO-3-(((1S)-2-PHENYL-1-(2-THIAZOLYL)ETHYL)AMINO)PROPYL)-1-PYRROLIDINYL)-1-((1S)-1-METHYLPROPYL)-4-OXOBUTYL)-N-METHYL-L-VALINAMIDE

Systematic Name

English

L-VALINAMIDE, N-METHYL-L-VALYL-N-((1S,2R)-2-METHOXY-4-((2S)-2-((1R,2R)-1-METHOXY-2-METHYL-3-OXO-3-(((1S)-2-PHENYL-1-(2-THIAZOLYL)ETHYL)AMINO)PROPYL)-1-PYRROLIDINYL)-1-((1S)-1-METHYLPROPYL)-4-OXOBUTYL)-N-METHYL-

Systematic Name

English

MONOMETHYLDOLASTATIN 10

Common Name

English

Code System Code Type Description

FDA UNII

W4ZIA40FZ9

Created by admin on Tue Apr 01 22:59:43 GMT 2025 , Edited by admin on Tue Apr 01 22:59:43 GMT 2025

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PUBCHEM

10723894

Created by admin on Tue Apr 01 22:59:43 GMT 2025 , Edited by admin on Tue Apr 01 22:59:43 GMT 2025

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