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Substance Name: XM 321
RN: 153183-11-0
InChIKey: VPFBCSZFKQTTKA-WZJLIZBTSA-N

Molecular Formula

  • C35-H38-N2-O5

Molecular Weight

  • 566.6942
 
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Names and Synonyms

Results Name

  • XM 321

Synonyms

  • (4R-(4alpha,5alpha,6beta,7beta))-Hexahydro-5,6-dihydroxy-1,3-bis((3-hydroxymethyl)benzyl)-4,7-bis(phenylmethyl)-2H-1,3-diazepin-2-one
  • CU
  • XM321

Systematic Name

  • 2H-1,3-Diazepin-2-one, hexahydro-5,6-dihydroxy-1,3-bis((3-(hydroxymethyl)phenyl)methyl)-4,7-bis(phenylmethyl)-, (4R,5S,6S,7R)-

Registry Numbers

CAS Registry Number

  • 153183-11-0

System Generated Number

  • 0153183110

Structure Descriptors

InChI

1S/C35H38N2O5/c38-23-29-15-7-13-27(17-29)21-36-31(19-25-9-3-1-4-10-25)33(40)34(41)32(20-26-11-5-2-6-12-26)37(35(36)42)22-28-14-8-16-30(18-28)24-39/h1-18,31-34,38-41H,19-24H2/t31-,32-,33+,34+/m1/s1

InChIKey

VPFBCSZFKQTTKA-WZJLIZBTSA-N

Smiles

c1ccc(cc1)C[C@@H]2[C@@H]([C@H]([C@H](N(C(=O)N2Cc3cccc(c3)CO)Cc4cccc(c4)CO)Cc5ccccc5)O)O