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Details

Stereochemistry ACHIRAL
Molecular Formula C35H38N2O5
Molecular Weight 566.6879
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DMP-323

SMILES

c1ccc(cc1)C[C@]2([H])[C@@]([H])([C@]([H])([C@@]([H])(Cc3ccccc3)N(Cc4ccc(cc4)CO)C(=O)N2Cc5ccc(cc5)CO)O)O

InChI

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

HIDE SMILES / InChI

Molecular Formula C35H38N2O5
Molecular Weight 566.6879
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Jun 26 00:19:23 UTC 2021
Edited
by admin
on Sat Jun 26 00:19:23 UTC 2021
Record UNII
KXN3869XB2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DMP-323
Common Name English
JCR-424
Code English
2H-1,3-DIAZEPIN-2-ONE, HEXAHYDRO-5,6-DIHYDROXY-1,3-BIS((4-(HYDROXYMETHYL)PHENYL)METHYL)-4,7-BIS(PHENYLMETHYL)-, (4R-(4.ALPHA.,5.ALPHA.,6.BETA.,7.BETA.))-
Common Name English
(4R-(4A,5A,6B,7B))-HEXAHYDRO-5,6-DIHYDROXY-1,3-BIS((4-(HYDROXYMETHYL)PHENYL)METHYL)-4,7-BIS(PHENYLMETHYL)-2H-1,3-DIAZEPIN-2-ONE
Common Name English
XM-323
Code English
Code System Code Type Description
CAS
151867-81-1
Created by admin on Sat Jun 26 00:19:23 UTC 2021 , Edited by admin on Sat Jun 26 00:19:23 UTC 2021
PRIMARY
EPA CompTox
151867-81-1
Created by admin on Sat Jun 26 00:19:23 UTC 2021 , Edited by admin on Sat Jun 26 00:19:23 UTC 2021
PRIMARY
PUBCHEM
72404
Created by admin on Sat Jun 26 00:19:23 UTC 2021 , Edited by admin on Sat Jun 26 00:19:23 UTC 2021
PRIMARY
FDA UNII
KXN3869XB2
Created by admin on Sat Jun 26 00:19:23 UTC 2021 , Edited by admin on Sat Jun 26 00:19:23 UTC 2021
PRIMARY
Related Record Type Details
TARGET ORGANISM->INHIBITOR
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ACTIVE MOIETY