(3S,6S,7R,8R)-8-Benzyl-3-[3-[(isobutyryloxy)methoxy]-4-methoxypicolinamido]-6-methyl-4,9-dioxo-1,5-dioxonan-7-yl isobutyrate

CAS Registry Number®

517875-34-2

CAS Name

(3S,6S,7R,8R)-8-Benzyl-3-[3-[(isobutyryloxy)methoxy]-4-methoxypicolinamido]-6-methyl-4,9-dioxo-1,5-dioxonan-7-yl isobutyrate

Molecular Formula

C31H38N2O11

Molecular Mass

614.64

Cite this Page

(3S,6S,7R,8R)-8-Benzyl-3-[3-[(isobutyryloxy)methoxy]-4-methoxypicolinamido]-6-methyl-4,9-dioxo-1,5-dioxonan-7-yl isobutyrate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=517875-34-2 (retrieved 2024-11-21) (CAS RN: 517875-34-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C31H38N2O11/c1-17(2)28(35)42-16-41-26-23(39-6)12-13-32-24(26)27(34)33-22-15-40-30(37)21(14-20-10-8-7-9-11-20)25(19(5)43-31(22)38)44-29(36)18(3)4/h7-13,17-19,21-22,25H,14-16H2,1-6H3,(H,33,34)/t19-,21+,22-,25-/m0/s1

InChIKey

InChIKey=QGTOTYJSCYHYFK-RBODFLQRSA-N

SMILES

O(COC(C(C)C)=O)C1=C(C(N[C@@H]2C(=O)O[C@@H](C)[C@H](OC(C(C)C)=O)[C@@H](CC3=CC=CC=C3)C(=O)OC2)=O)N=CC=C1OC

Canonical SMILES

O=C(OCOC1=C(OC)C=CN=C1C(=O)NC2C(=O)OC(C)C(OC(=O)C(C)C)C(C(=O)OC2)CC=3C=CC=CC3)C(C)C

Other Names for this Substance

  • Propanoic acid, 2-methyl-, [[4-methoxy-2-[[[(3S,7R,8R,9S)-9-methyl-8-(2-methyl-1-oxopropoxy)-2,6-dioxo-7-(phenylmethyl)-1,5-dioxonan-3-yl]amino]carbonyl]-3-pyridinyl]oxy]methyl ester
  • [[4-Methoxy-2-[[[(3S,7R,8R,9S)-9-methyl-8-(2-methyl-1-oxopropoxy)-2,6-dioxo-7-(phenylmethyl)-1,5-dioxonan-3-yl]amino]carbonyl]-3-pyridinyl]oxy]methyl 2-methylpropanoate
  • XDE 777
  • (3S,6S,7R,8R)-8-Benzyl-3-[([3-[(isobutyryloxy)methoxy]-4-methoxypyridin-2-yl]carbonyl)amino]-6-methyl-4,9-dioxo-1,5-dioxonan-7-yl 2-methylpropanoate
  • UK 2A procide

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CAS INSIGHTSTM
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