2-[N2-(4-Azido-2,3,5,6-tetrafluorobenzoyl)-N6-(6-biotinamidocaproyl)-L-lysinyl]ethyl Methanethiosulf - CAS 1356383-18-0

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Catalog Number: R001199

CAS Number: 1356383-18-0

PubChem Substance ID:355100494

Molecular Formula: C32H45F4N9O7S3

Molecular Weight:839.942

Purity: ≥95%

* For research use only. Not for human or veterinary use.


Property

Molecular Formula: C32H45F4N9O7S3
Molecular Weight839.942
Purity≥95%
StorageStore at -20°C

Computed Descriptor

IUPAC NameN-[(2S)-6-[6-[5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoylamino]hexanoylamino]-1-(2-methylsulfonylsulfanylethylamino)-1-oxohexan-2-yl]-4-azido-2,3,5,6-tetrafluorobenzamide
InChIInChI=1S/C32H45F4N9O7S3/c1-55(51,52)54-16-15-40-30(48)18(41-31(49)23-24(33)26(35)29(44-45-37)27(36)25(23)34)9-6-8-14-39-21(46)11-3-2-7-13-38-22(47)12-5-4-10-20-28-19(17-53-20)42-32(50)43-28/h18-20,28H,2-17H2,1H3,(H,38,47)(H,39,46)(H,40,48)(H,41,49)(H2,42,43,50)/t18-,19-,20-,28-/m0/s1
InChIKeyMOJQBNGTBRYNMF-OOJAGLQYSA-N
SMILESCS(=O)(=O)SCCNC(=O)C(CCCCNC(=O)CCCCCNC(=O)CCCCC1C2C(CS1)NC(=O)N2)NC(=O)C3=C(C(=C(C(=C3F)F)N=[N+]=[N-])F)F