LT0
Summary
Name: | D-tryptophyl-L-serine |
Synonyms: | (2~{S})-2-[[(2~{R})-2-azanyl-3-(1~{H}-indol-3-yl)propanoyl]amino]-3-oxidanyl-propanoic acid D-Trp-Ser dipeptide |
Formula: | C14 H17 N3 O4 |
Formal charge: | 0 |
Formula weight: | 291.302 Da |
Component type: | peptide linking |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | (2~{S})-2-[[(2~{R})-2-azanyl-3-(1~{H}-indol-3-yl)propanoyl]amino]-3-oxidanyl-propanoic acid |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.06 | InChI=1S/C14H17N3O4/c15-10(13(19)17-12(7-18)14(20)21)5-8-6-16-11-4-2-1-3-9(8)11/h1-4,6,10,12,16,18H,5,7,15H2,(H,17,19)(H,20,21)/t10-,12+/m1/s1 |
InChIKey | InChI | 1.06 | MYVYPSWUSKCCHG-PWSUYJOCSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CO)C(O)=O |
SMILES | CACTVS | 3.385 | N[CH](Cc1c[nH]c2ccccc12)C(=O)N[CH](CO)C(O)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)c(c[nH]2)C[C@H](C(=O)N[C@@H](CO)C(=O)O)N |
SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)c(c[nH]2)CC(C(=O)NC(CO)C(=O)O)N |