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  2. (E)-2-[[(E)-2-[[(2S)-1-[(2S,6S,9S,10R)-14-chloro-10-ethyl-2,13-dihydroxy-10-methyl-3-(methylamino)-4,7-dioxo-6-prop-1-en-2-yl-11-oxa-5,8-diazabicyclo[10.3.1]hexadeca-1(16),12,14-triene-9-carbonyl]-2,5-dihydropyrrole-2-carbonyl]amino]-3-methylpent-2-enoyl]amino]but-2-enedioic acid

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Brc1cnc(nc1)C
Pyrimidine, 5-bromo-2-methyl-
CCCP1(=O)OP(=O)(CCC)OP(=O)(O1)CCC
1,3,5,2,4,6-Trioxatriphosphorinane, 2,4,6-tripropyl-, 2,4,6-trioxide
CC1(C)OB(OC1(C)C)B1OC(C(O1)(C)C)(C)C
2,2'-Bi-1,3,2-dioxaborolane, 4,4,4',4',5,5,5',5'-octamethyl-
O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.[Pd].[Pd]
Tris(dibenzylideneacetone)dipalladium
C1CCC(CC1)P(C1CCCCC1)C1CCCCC1.Cc1cc(C)c(c(c1)C)N1CCN(C1=[Ru](=Cc1ccccc1)(Cl)Cl)c1c(C)cc(cc1C)C
Ruthenium,[1,3-bis(2,4,6-trimethylphenyl)-2-imidazolidinylidene]dichloro(phenylmethylene)(tricyclohexylphosphine)-, (SP-5-41)-

(E)-2-[[(E)-2-[[(2S)-1-[(2S,6S,9S,10R)-14-chloro-10-ethyl-2,13-dihydroxy-10-methyl-3-(methylamino)-4,7-dioxo-6-prop-1-en-2-yl-11-oxa-5,8-diazabicyclo[10.3.1]hexadeca-1(16),12,14-triene-9-carbonyl]-2,5-dihydropyrrole-2-carbonyl]amino]-3-methylpent-2-enoyl]amino]but-2-enedioic acid

CN[C@@H]1C(=O)N[C@@H](C(=C)C)C(=O)N[C@H]([C@@](Oc2cc([C@@H]1O)cc(c2O)Cl)(C)CC)C(=O)N1CC=C[C@H]1C(=O)N/C(=C(/CC)C)/C(=O)N/C(=C/C(=O)O)/C(=O)O Request for Quotation
Chemical Name: (E)-2-[[(E)-2-[[(2S)-1-[(2S,6S,9S,10R)-14-chloro-10-ethyl-2,13-dihydroxy-10-methyl-3-(methylamino)-4,7-dioxo-6-prop-1-en-2-yl-11-oxa-5,8-diazabicyclo[10.3.1]hexadeca-1(16),12,14-triene-9-carbonyl]-2,5-dihydropyrrole-2-carbonyl]amino]-3-methylpent-2-enoyl]amino]but-2-enedioic acid
CAS Number: 64925-80-0
Product Number: AG00EBB5(AGN-PC-0D29VQ)
Synonyms:
MDL No:
Molecular Formula: C36H45ClN6O12
Molecular Weight: 789.2285

Identification/Properties

Computed Properties
Molecular Weight:
789.236g/mol
XLogP3:
0.3
Hydrogen Bond Donor Count:
9
Hydrogen Bond Acceptor Count:
13
Rotatable Bond Count:
11
Exact Mass:
788.278g/mol
Monoisotopic Mass:
788.278g/mol
Topological Polar Surface Area:
273A^2
Heavy Atom Count:
55
Formal Charge:
0
Complexity:
1660
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
6
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information

NMR Spectrum

Other Analytical Data

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