2,3,5,6-Tetrafluorophenyl (18S)-26-(2,5-dihydro-2,5-dioxo-1H-pyrrol-1-yl)-18-[[3-(2,5-dihydro-2,5-dioxo-1H-pyrrol-1-yl)-1-oxopropyl]amino]-17,24-dioxo-4,7,10,13-tetraoxa-16,23-diazahexacosanoate

CAS Registry Number®

1426164-53-5

CAS Name

2,3,5,6-Tetrafluorophenyl (18S)-26-(2,5-dihydro-2,5-dioxo-1H-pyrrol-1-yl)-18-[[3-(2,5-dihydro-2,5-dioxo-1H-pyrrol-1-yl)-1-oxopropyl]amino]-17,24-dioxo-4,7,10,13-tetraoxa-16,23-diazahexacosanoate

Molecular Formula

C37H45F4N5O13

Molecular Mass

843.77

Cite this Page

2,3,5,6-Tetrafluorophenyl (18S)-26-(2,5-dihydro-2,5-dioxo-1H-pyrrol-1-yl)-18-[[3-(2,5-dihydro-2,5-dioxo-1H-pyrrol-1-yl)-1-oxopropyl]amino]-17,24-dioxo-4,7,10,13-tetraoxa-16,23-diazahexacosanoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1426164-53-5 (retrieved 2024-11-27) (CAS RN: 1426164-53-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C37H45F4N5O13/c38-24-23-25(39)35(41)36(34(24)40)59-33(53)10-15-55-17-19-57-21-22-58-20-18-56-16-12-43-37(54)26(44-28(48)9-14-46-31(51)6-7-32(46)52)3-1-2-11-42-27(47)8-13-45-29(49)4-5-30(45)50/h4-7,23,26H,1-3,8-22H2,(H,42,47)(H,43,54)(H,44,48)/t26-/m0/s1

InChIKey

InChIKey=QODWSCJQLAMMBN-SANMLTNESA-N

SMILES

O(C(CCOCCOCCOCCOCCNC([C@@H](NC(CCN1C(=O)C=CC1=O)=O)CCCCNC(CCN2C(=O)C=CC2=O)=O)=O)=O)C3=C(F)C(F)=CC(F)=C3F

Canonical SMILES

O=C(OC=1C(F)=C(F)C=C(F)C1F)CCOCCOCCOCCOCCNC(=O)C(NC(=O)CCN2C(=O)C=CC2=O)CCCCNC(=O)CCN3C(=O)C=CC3=O

Other Names for this Substance

  • 4,7,10,13-Tetraoxa-16,23-diazahexacosanoic acid, 26-(2,5-dihydro-2,5-dioxo-1H-pyrrol-1-yl)-18-[[3-(2,5-dihydro-2,5-dioxo-1H-pyrrol-1-yl)-1-oxopropyl]amino]-17,24-dioxo-, 2,3,5,6-tetrafluorophenyl ester, (18S)-
  • 2,3,5,6-Tetrafluorophenyl (18S)-26-(2,5-dihydro-2,5-dioxo-1H-pyrrol-1-yl)-18-[[3-(2,5-dihydro-2,5-dioxo-1H-pyrrol-1-yl)-1-oxopropyl]amino]-17,24-dioxo-4,7,10,13-tetraoxa-16,23-diazahexacosanoate

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