Cas no 96838-41-4 (L-Tryptophan, 2-(methylthio)-N-[2-(methylthio)-N-[(phenylmethoxy)carbonyl]-L-tryptophyl]-, methyl ester)

L-Tryptophan, 2-(methylthio)-N-[2-(methylthio)-N-[(phenylmethoxy)carbonyl]-L-tryptophyl]-, methyl ester structure
96838-41-4 structure
Product Name:L-Tryptophan, 2-(methylthio)-N-[2-(methylthio)-N-[(phenylmethoxy)carbonyl]-L-tryptophyl]-, methyl ester
CAS No:96838-41-4
MF:C33H34N4O5S2
MW:630.77686548233
CID:6625247
Update Time:2024-01-15

L-Tryptophan, 2-(methylthio)-N-[2-(methylthio)-N-[(phenylmethoxy)carbonyl]-L-tryptophyl]-, methyl ester Chemical and Physical Properties

Names and Identifiers

    • L-Tryptophan, 2-(methylthio)-N-[2-(methylthio)-N-[(phenylmethoxy)carbonyl]-L-tryptophyl]-, methyl ester
    • Inchi: 1S/C33H34N4O5S2/c1-41-32(39)28(18-24-22-14-8-10-16-26(22)36-31(24)44-3)34-29(38)27(37-33(40)42-19-20-11-5-4-6-12-20)17-23-21-13-7-9-15-25(21)35-30(23)43-2/h4-16,27-28,35-36H,17-19H2,1-3H3,(H,34,38)(H,37,40)/t27-,28-/m0/s1
    • InChI Key: KTBOICDZPWHEPN-NSOVKSMOSA-N
    • SMILES: C(OC)(=O)[C@H](CC1C2=C(C=CC=C2)NC=1SC)NC(=O)[C@H](CC1C2=C(C=CC=C2)NC=1SC)NC(OCC1=CC=CC=C1)=O

Experimental Properties

  • Density: 1.37±0.1 g/cm3(Temp: 20 °C; Press: 760 Torr)(Predicted)
  • Boiling Point: 915.7±65.0 °C(Predicted)
  • pka: 10.84±0.46(Predicted)
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