(3R,8S)-1-(1,1-Dimethylethoxy)-12,12-dimethyl-1,10-dioxo-11-oxa-5-thia-2,9-diazatridecanoic acid

CAS Registry Number®

64905-03-9
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CAS Name

(3R,8S)-1-(1,1-Dimethylethoxy)-12,12-dimethyl-1,10-dioxo-11-oxa-5-thia-2,9-diazatridecanoic acid

Molecular Formula

C17H30N2O8S

Molecular Mass

422.49

Cite this Page

(3R,8S)-1-(1,1-Dimethylethoxy)-12,12-dimethyl-1,10-dioxo-11-oxa-5-thia-2,9-diazatridecanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=64905-03-9 (retrieved 2024-08-02) (CAS RN: 64905-03-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C17H30N2O8S/c1-16(2,3)26-14(24)18-10(12(20)21)7-8-28-9-11(13(22)23)19-15(25)27-17(4,5)6/h10-11H,7-9H2,1-6H3,(H,18,24)(H,19,25)(H,20,21)(H,22,23)/t10-,11-/m0/s1

InChIKey

InChIKey=IFBKMIZPKGMIEK-QWRGUYRKSA-N

SMILES

[C@H](NC(OC(C)(C)C)=O)(CCSC[C@H](NC(OC(C)(C)C)=O)C(O)=O)C(O)=O

Canonical SMILES

O=C(OC(C)(C)C)NC(C(=O)O)CSCCC(NC(=O)OC(C)(C)C)C(=O)O

Other Names for this Substance

  • 11-Oxa-5-thia-2,9-diazatridecanoic acid, 1-(1,1-dimethylethoxy)-12,12-dimethyl-1,10-dioxo-, (3R,8S)-
  • L-Homocysteine, S-[2-carboxy-2-[[(1,1-dimethylethoxy)carbonyl]amino]ethyl]-N-[(1,1-dimethylethoxy)carbonyl]-, (R)-
  • (3R,8S)-1-(1,1-Dimethylethoxy)-12,12-dimethyl-1,10-dioxo-11-oxa-5-thia-2,9-diazatridecanoic acid