CAS Registry Number®
1260617-50-2
Molecular Formula
C30H42N2O11Molecular Mass
606.66Cite this Page
. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=1260617-50-2 (retrieved ) (CAS RN: 1260617-50-2). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C30H42N2O11/c1-3-41-28(39)19(14-13-17-9-5-4-6-10-17)31-16(2)26(36)32-20-12-8-7-11-18(20)15-21(32)29(40)43-30-24(35)22(33)23(34)25(42-30)27(37)38/h4-6,9-10,16,18-25,30-31,33-35H,3,7-8,11-15H2,1-2H3,(H,37,38)/t16-,18+,19-,20-,21-,22-,23-,24+,25-,30-/m0/s1
InChIKey
InChIKey=XIVXFEAPQLOONX-UCXQGGPXSA-N
SMILES
C([C@@H](N[C@@H](CCC1=CC=CC=C1)C(OCC)=O)C)(=O)N2[C@@]3([C@@](C[C@H]2C(O[C@@H]4O[C@H](C(O)=O)[C@@H](O)[C@H](O)[C@H]4O)=O)(CCCC3)[H])[H]
Canonical SMILES
O=C(O)C1OC(OC(=O)C2N(C(=O)C(NC(C(=O)OCC)CCC=3C=CC=CC3)C)C4CCCCC4C2)C(O)C(O)C1O
Other Names for this Substance
- Trandolapril glucuronide