11-(((3beta-Hydroxylup-20(29)-En-28-Oyl)Methyl)Amino)Aminoundecanoic Acid
[CAS# 173106-54-2]

Identification

• Name: 11-(((3beta-Hydroxylup-20(29)-En-28-Oyl)Methyl)Amino)Aminoundecanoic Acid
• Synonyms: Undecanoic Acid, 11-(((3Beta)-3-Hydroxylup-20(29)-En-28-Yl)Amino)-; Aids-033541; Aids033541
• Molecular Formula: C₄₁H₇₁NO₃
• Molecular Weight: 626.02
• CAS Registry Number: 173106-54-2
• SMILES: [C@@]35([C@]2([C@@H]([C@@]1([C@H](C([C@H](CC1)O)(C)C)CC2)C)CC[C@@H]3[C@H]4[C@H](C(=C)C)CC[C@@]4(CC5)CNCCCCCCCCCCC(=O)O)C)C
• InChI: 1S/C41H71NO3/c1-29(2)30-19-24-41(28-42-27-15-13-11-9-8-10-12-14-16-35(44)45)26-25-39(6)31(36(30)41)17-18-33-38(5)22-21-34(43)37(3,4)32(38)20-23-40(33,39)7/h30-34,36,42-43H,1,8-28H2,2-7H3,(H,44,45)/t30-,31+,32-,33+,34-,36+,38-,39+,40+,41+/m0/s1
• InChIKey: LHUVKQWBZICRFR-LCLRTRGPSA-N

Properties

• Density: 1.005g/cm³ (Cal.)
• Boiling point: 685.614°C at 760 mmHg (Cal.)
• Flash point: 368.446°C (Cal.)