Tasidotin C-carboxylate

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C28H49N5O6
Molecular Weight	551.7186
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC(C)[C@H](NC(=O)[C@H](C(C)C)N(C)C)C(=O)N(C)[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N2CCC[C@H]2C(O)=O

InChI

InChIKey=KBJXXHTUXGXWFS-VUBDRERZSA-N

InChI=1S/C28H49N5O6/c1-16(2)21(29-24(34)22(17(3)4)30(7)8)26(36)31(9)23(18(5)6)27(37)32-14-10-12-19(32)25(35)33-15-11-13-20(33)28(38)39/h16-23H,10-15H2,1-9H3,(H,29,34)(H,38,39)/t19-,20-,21-,22-,23-/m0/s1

HIDE SMILES / InChI

Approval Year

Name

Type

Language

Tasidotin C-carboxylate

Common Name

English

L-Proline, N,N-dimethyl-L-valyl-L-valyl-N-methyl-L-valyl-L-prolyl-

Common Name

English

N,N-Dimethyl-L-valyl-L-valyl-N-methyl-L-valyl-L-prolyl-L-proline

Common Name

English

(2S)-1-[(2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-2-(dimethylamino)-3-methylbutanoyl]amino]-3-methylbutanoyl]-methylamino]-3-methylbutanoyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carboxylicacid

Systematic Name

English

Code System Code Type Description

PUBCHEM

11060690

Created by admin on Sat Dec 16 19:56:49 GMT 2023 , Edited by admin on Sat Dec 16 19:56:49 GMT 2023

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FDA UNII

UZ39H382VU

Created by admin on Sat Dec 16 19:56:49 GMT 2023 , Edited by admin on Sat Dec 16 19:56:49 GMT 2023

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EPA CompTox

DTXSID50453683

Created by admin on Sat Dec 16 19:56:49 GMT 2023 , Edited by admin on Sat Dec 16 19:56:49 GMT 2023

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CAS

215393-04-7

Created by admin on Sat Dec 16 19:56:49 GMT 2023 , Edited by admin on Sat Dec 16 19:56:49 GMT 2023

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ACTIVE MOIETY


					UZ39H382VU

Tasidotin C-carboxylate

PARENT (METABOLITE ACTIVE)


					05G07285DK

TASIDOTIN