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N-Me-L-Ala-maytansinol [77668-69-0]

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Identification
Name N-Me-L-Ala-maytansinol
Synonyms [(1S,2R,3S,5S,6S,16E,18E,20R,21S)-11-chloro-21-hydroxy-12,20-dimethoxy-2,5,9,16-tetramethyl-8,23-dioxo-4,24-dioxa-9,22-diazatetracyclo[19.3.1.110,14.03,5]hexacosa-10,12,14(26),16,18-pentaen-6-yl] (2S)-2-(methylamino)propanoate
Molecular Structure CAS # 77668-69-0, N-Me-L-Ala-maytansinol, [(1S,2R,3S,5S,6S,16E,18E,20R,21S)-11-chloro-21-hydroxy-12,20-dimethoxy-2,5,9,16-tetramethyl-8,23-dioxo-4,24-dioxa-9,22-diazatetracyclo[19.3.1.110,14.03,5]hexacosa-10,12,14(26),16,18-pentaen-6-yl] (2S)-2-(methylamino)propanoate
Molecular Weight 650.16
CAS Registry Number 77668-69-0
SMILES C[C@@H]1[C@@H]2C[C@]([C@@H](/C=C/C=C(/CC3=CC(=C(C(=C3)OC)Cl)N(C(=O)C[C@@H]([C@]4([C@H]1O4)C)OC(=O)[C@H](C)NC)C)\C)OC)(NC(=O)O2)O
 
Properties
Density 1.3±0.1 g/cm3, Calc.*
Index of Refraction 1.588, Calc.*
Boiling Point 849.5±65.0 ºC (760 mmHg), Calc.*
Flash Point 467.6±34.3 ºC, Calc.*
 
* Calculated using Advanced Chemistry Development (ACD/Labs) Software.
 
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