N-Hexanoyl-5-hydroxytryptophyl-5-hydroxytryptophanamide
[CAS# 90829-99-5]

Identification

• Name: N-Hexanoyl-5-hydroxytryptophyl-5-hydroxytryptophanamide
• Synonyms: N-[(1S)-2-[[(2S)-2-Amino-3-(5-Hydroxy-1H-Indol-3-Yl)Propanoyl]Amino]-1-[(5-Hydroxy-1H-Indol-3-Yl)Methyl]-2-Oxo-Ethyl]Hexanamide; N-[(1S)-2-[[(2S)-2-Amino-3-(5-Hydroxy-1H-Indol-3-Yl)-1-Oxopropyl]Amino]-1-[(5-Hydroxy-1H-Indol-3-Yl)Methyl]-2-Oxoethyl]Hexanami
• Molecular Formula: C₂₈H₃₃N₅O₅
• Molecular Weight: 519.60
• CAS Registry Number: 90829-99-5
• SMILES: [C@H](NC(=O)CCCCC)(CC1=C[NH]C2=CC=C(O)C=C12)C(=O)NC(=O)[C@@H](N)CC3=C[NH]C4=CC=C(O)C=C34
• InChI: 1S/C28H33N5O5/c1-2-3-4-5-26(36)32-25(11-17-15-31-24-9-7-19(35)13-21(17)24)28(38)33-27(37)22(29)10-16-14-30-23-8-6-18(34)12-20(16)23/h6-9,12-15,22,25,30-31,34-35H,2-5,10-11,29H2,1H3,(H,32,36)(H,33,37,38)/t22-,25-/m0/s1
• InChIKey: HZDHFCVARKEHFK-DHLKQENFSA-N

Properties

• Density: 1.356g/cm³ (Cal.)
• Boiling point: 927.794°C at 760 mmHg (Cal.)
• Flash point: 514.911°C (Cal.)