(2R,3S,5S)-5-[2-[[(4-Methoxyphenyl)diphenylmethyl]amino]-6-(phenylmethoxy)-9H-purin-9-yl]-3-(phenylmethoxy)-2-[(phenylmethoxy)methyl]cyclopentanone

CAS Registry Number®

142217-79-6
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CAS Name

(2R,3S,5S)-5-[2-[[(4-Methoxyphenyl)diphenylmethyl]amino]-6-(phenylmethoxy)-9H-purin-9-yl]-3-(phenylmethoxy)-2-[(phenylmethoxy)methyl]cyclopentanone

Molecular Formula

C52H47N5O5

Molecular Mass

821.96

Cite this Page

(2R,3S,5S)-5-[2-[[(4-Methoxyphenyl)diphenylmethyl]amino]-6-(phenylmethoxy)-9H-purin-9-yl]-3-(phenylmethoxy)-2-[(phenylmethoxy)methyl]cyclopentanone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=142217-79-6 (retrieved 2024-06-26) (CAS RN: 142217-79-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C52H47N5O5/c1-59-43-29-27-42(28-30-43)52(40-23-13-5-14-24-40,41-25-15-6-16-26-41)56-51-54-49-47(50(55-51)62-34-39-21-11-4-12-22-39)53-36-57(49)45-31-46(61-33-38-19-9-3-10-20-38)44(48(45)58)35-60-32-37-17-7-2-8-18-37/h2-30,36,44-46H,31-35H2,1H3,(H,54,55,56)/t44-,45+,46+/m1/s1

InChIKey

InChIKey=JBDUMGNQMZHOMS-QZVMJXQOSA-N

SMILES

C(NC=1N=C2N(C=NC2=C(OCC3=CC=CC=C3)N1)[C@H]4C[C@H](OCC5=CC=CC=C5)[C@@H](COCC6=CC=CC=C6)C4=O)(C7=CC=C(OC)C=C7)(C8=CC=CC=C8)C9=CC=CC=C9

Canonical SMILES

O=C1C(N2C=NC=3C(=NC(=NC32)NC(C=4C=CC=CC4)(C=5C=CC=CC5)C6=CC=C(OC)C=C6)OCC=7C=CC=CC7)CC(OCC=8C=CC=CC8)C1COCC=9C=CC=CC9

Other Names for this Substance

  • Cyclopentanone, 5-[2-[[(4-methoxyphenyl)diphenylmethyl]amino]-6-(phenylmethoxy)-9H-purin-9-yl]-3-(phenylmethoxy)-2-[(phenylmethoxy)methyl]-, (2R,3S,5S)-
  • Cyclopentanone, 5-[2-[[(4-methoxyphenyl)diphenylmethyl]amino]-6-(phenylmethoxy)-9H-purin-9-yl]-3-(phenylmethoxy)-2-[(phenylmethoxy)methyl]-, [2R-(2α,3β,5α)]-
  • (2R,3S,5S)-5-[2-[[(4-Methoxyphenyl)diphenylmethyl]amino]-6-(phenylmethoxy)-9H-purin-9-yl]-3-(phenylmethoxy)-2-[(phenylmethoxy)methyl]cyclopentanone