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Details

Stereochemistry ABSOLUTE
Molecular Formula C28H32N4O8
Molecular Weight 552.5757
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BE-70016

SMILES

COC(=O)[C@@H](CCCNC(=O)[C@H]1N=C(O[C@@H]1C)C2=CC=CC=C2O)NC(=O)[C@H]3N=C(O[C@@H]3C)C4=CC=CC=C4O

InChI

InChIKey=VNRGGNMDGIRASY-UTUXXGMESA-N
InChI=1S/C28H32N4O8/c1-15-22(31-26(39-15)17-9-4-6-12-20(17)33)24(35)29-14-8-11-19(28(37)38-3)30-25(36)23-16(2)40-27(32-23)18-10-5-7-13-21(18)34/h4-7,9-10,12-13,15-16,19,22-23,33-34H,8,11,14H2,1-3H3,(H,29,35)(H,30,36)/t15-,16-,19-,22+,23+/m1/s1

HIDE SMILES / InChI

Molecular Formula C28H32N4O8
Molecular Weight 552.5757
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 5 / 5
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 23:18:30 GMT 2025
Edited
by admin
on Mon Mar 31 23:18:30 GMT 2025
Record UNII
X73MVJ4Q01
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BE-70016
Common Name English
D-ORNITHYL-BE-70016O
Preferred Name English
D-ORNITHINE, N2,N5-BIS(((4S,5R)-4,5-DIHYDRO-2-(2-HYDROXYPHENYL)-5-METHYL-4-OXAZOLYL)CARBONYL)-, METHYL ESTER
Systematic Name English
Code System Code Type Description
CAS
257939-93-8
Created by admin on Mon Mar 31 23:18:30 GMT 2025 , Edited by admin on Mon Mar 31 23:18:30 GMT 2025
PRIMARY
PUBCHEM
135540983
Created by admin on Mon Mar 31 23:18:30 GMT 2025 , Edited by admin on Mon Mar 31 23:18:30 GMT 2025
PRIMARY
FDA UNII
X73MVJ4Q01
Created by admin on Mon Mar 31 23:18:30 GMT 2025 , Edited by admin on Mon Mar 31 23:18:30 GMT 2025
PRIMARY
Related Record Type Details
ACTIVE MOIETY