(4α,8α,12α,13R,14S)-16-(1-Methylethyl)-17,19-dinoratis-15-ene-4,13,14-tricarboxylic acid
CAS Registry Number®
125-66-6
CAS Name
(4α,8α,12α,13R,14S)-16-(1-Methylethyl)-17,19-dinoratis-15-ene-4,13,14-tricarboxylic acidMolecular Formula
C24H34O6Molecular Mass
418.52Cite this Page
(4α,8α,12α,13R,14S)-16-(1-Methylethyl)-17,19-dinoratis-15-ene-4,13,14-tricarboxylic acid. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=125-66-6 (retrieved ) (CAS RN: 125-66-6). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
170-179 °C (decomp)
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C24H34O6/c1-12(2)14-11-24-9-6-15-22(3,7-5-8-23(15,4)21(29)30)16(24)10-13(14)17(19(25)26)18(24)20(27)28/h11-13,15-18H,5-10H2,1-4H3,(H,25,26)(H,27,28)(H,29,30)/t13-,15+,16+,17+,18+,22-,23+,24-/m0/s1
InChIKey
InChIKey=PXYRCOIAFZBLBN-HQJFNQTASA-N
SMILES
C(O)(=O)[C@@H]1[C@@]23[C@@]([C@]4(C)[C@@](CC2)([C@@](C(O)=O)(C)CCC4)[H])(C[C@]([C@H]1C(O)=O)(C(C(C)C)=C3)[H])[H]
Canonical SMILES
O=C(O)C1C2C(=CC3(CCC4C(C(=O)O)(C)CCCC4(C)C3C2)C1C(=O)O)C(C)C
Other Names for this Substance
- 17,19-Dinoratis-15-ene-4,13,14-tricarboxylic acid, 16-(1-methylethyl)-, (4α,8α,12α,13R,14S)-
- Atis-13-ene-17,18-dioic acid, 15α-carboxy-13-isopropyl-
- Fumaropimaric acid
- 3H-3,10a-Ethanophenanthrene, 17,19-dinoratis-15-ene-4,13,14-tricarboxylic acid deriv.
- (4α,8α,12α,13R,14S)-16-(1-Methylethyl)-17,19-dinoratis-15-ene-4,13,14-tricarboxylic acid
Deleted or Replaced CAS Registry Numbers
19742-24-6, 21654-14-8, 29283-39-4, 2097107-48-5