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155877-83-1 | Benzoic acid, 4-(7,8,9,10-tetrahydro-5,7,7,10,10-pentamethyl-5H-benzo[e]naphtho[2,3-b][1,4]diazepin-13-yl)-
CAS No: 155877-83-1 Catalog No: AG001OAQ MDL No:
Product Description
Catalog Number:
AG001OAQ
Chemical Name:
Benzoic acid, 4-(7,8,9,10-tetrahydro-5,7,7,10,10-pentamethyl-5H-benzo[e]naphtho[2,3-b][1,4]diazepin-13-yl)-
CAS Number:
155877-83-1
Molecular Formula:
C29H30N2O2
Molecular Weight:
438.5607
IUPAC Name:
4-(5,7,7,10,10-pentamethyl-8,9-dihydronaphtho[2,3-b][1,4]benzodiazepin-13-yl)benzoic acid
InChI:
InChI=1S/C29H30N2O2/c1-28(2)14-15-29(3,4)22-17-25-23(16-21(22)28)30-26(18-10-12-19(13-11-18)27(32)33)20-8-6-7-9-24(20)31(25)5/h6-13,16-17H,14-15H2,1-5H3,(H,32,33)
InChI Key:
YZZAIQOVMHVWBS-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(cc1)C1=Nc2cc3c(cc2N(c2c1cccc2)C)C(C)(C)CCC3(C)C
Properties
Complexity:
779
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
438.231g/mol
Formal Charge:
0
Heavy Atom Count:
33
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
438.571g/mol
Monoisotopic Mass:
438.231g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
52.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.4
Literature
| Title | Journal |
|---|---|
| Retinoids and rexinoids inhibit hepatitis C virus independently of retinoid receptor signaling. | Microbes and infection 20140201 |
| Cloning and expression of a retinoic acid receptor β2 subtype from the adult newt: evidence for an early role in tail and caudal spinal cord regeneration. | Developmental dynamics : an official publication of the American Association of Anatomists 20111201 |
| Chondrogenic effects of exogenous retinoic acid or a retinoic acid receptor antagonist (LE135) on equine chondrocytes and bone marrow-derived mesenchymal stem cells in monolayer culture. | American journal of veterinary research 20110701 |
| Establishment of a rescue program for anorectal malformations induced by retinoic acid in mice. | Journal of pediatric surgery 20110701 |
| The role of retinoic acid receptor inhibitor LE135 on the osteochondral differentiation of human bone marrow mesenchymal stem cells. | Journal of cellular biochemistry 20110301 |
| Retinoids regulate human amniotic tissue-type plasminogen activator gene by a two-step mechanism. | Journal of cellular and molecular medicine 20100601 |
| All-trans retinoic acid ameliorates trinitrobenzene sulfonic acid-induced colitis by shifting Th1 to Th2 profile. | Journal of interferon & cytokine research : the official journal of the International Society for Interferon and Cytokine Research 20100601 |
| All-trans retinoic acid down-regulates inflammatory responses by shifting the Treg/Th17 profile in human ulcerative and murine colitis. | Journal of leukocyte biology 20091001 |
| The transcription factors Nur77 and retinoid X receptors participate in amphetamine-induced locomotor activities. | Psychopharmacology 20090301 |
| Pharmacological regulation of adult stem cells: chondrogenesis can be induced using a synthetic inhibitor of the retinoic acid receptor. | Stem cells (Dayton, Ohio) 20071001 |
| Retinoic acid via RARalpha inhibits the expression of 24-hydroxylase in human prostate stromal cells. | Biochemical and biophysical research communications 20051230 |
| Krüppel-like zinc-finger transcription factor KLF5/BTEB2 is a target for angiotensin II signaling and an essential regulator of cardiovascular remodeling. | Nature medicine 20020801 |
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