Butanedioic acid, compd. with 1,1-dimethylethyl [(1S,3S,4S)-4-amino-3-hydroxy-5-phenyl-1-(phenylmethyl)pentyl]carbamate (1:1)
CAS Registry Number®
256328-84-4
CAS Name
Butanedioic acid, compd. with 1,1-dimethylethyl [(1S,3S,4S)-4-amino-3-hydroxy-5-phenyl-1-(phenylmethyl)pentyl]carbamate (1:1)Molecular Formula
C23H32N2O3.C4H6O4Cite this Page
Butanedioic acid, compd. with 1,1-dimethylethyl [(1S,3S,4S)-4-amino-3-hydroxy-5-phenyl-1-(phenylmethyl)pentyl]carbamate (1:1). CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=256328-84-4 (retrieved ) (CAS RN: 256328-84-4). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C23H32N2O3.C4H6O4/c1-23(2,3)28-22(27)25-19(14-17-10-6-4-7-11-17)16-21(26)20(24)15-18-12-8-5-9-13-18;5-3(6)1-2-4(7)8/h4-13,19-21,26H,14-16,24H2,1-3H3,(H,25,27);1-2H2,(H,5,6)(H,7,8)/t19-,20-,21-;/m0./s1
InChIKey
InChIKey=ZICUGSIJUKRRJL-OCIDDWSYSA-N
SMILES
[C@H](CC1=CC=CC=C1)(C[C@@H]([C@H](CC2=CC=CC=C2)N)O)NC(OC(C)(C)C)=O.C(CC(O)=O)C(O)=O
Canonical SMILES
O=C(O)CCC(=O)O.O=C(OC(C)(C)C)NC(CC=1C=CC=CC1)CC(O)C(N)CC=2C=CC=CC2
Other Names for this Substance
- Butanedioic acid, compd. with 1,1-dimethylethyl [(1S,3S,4S)-4-amino-3-hydroxy-5-phenyl-1-(phenylmethyl)pentyl]carbamate (1:1)
- Carbamic acid, [(1S,3S,4S)-4-amino-3-hydroxy-5-phenyl-1-(phenylmethyl)pentyl]-, 1,1-dimethylethyl ester, butanedioate (1:1) (salt)
