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26241-51-0 | 24-Norchola-1,14,20,22-tetraene-3,16-dione, 7-(acetyloxy)-21,23-epoxy-4,4,8-trimethyl-, (5α,7α,13α,17α)-
CAS No: 26241-51-0 Catalog No: AG002SFM MDL No:
Product Description
Catalog Number:
AG002SFM
Chemical Name:
24-Norchola-1,14,20,22-tetraene-3,16-dione, 7-(acetyloxy)-21,23-epoxy-4,4,8-trimethyl-, (5α,7α,13α,17α)-
CAS Number:
26241-51-0
IUPAC Name:
[(5R,7R,8R,9R,10R,13S,17R)-17-(furan-3-yl)-4,4,8,10,13-pentamethyl-3,16-dioxo-6,7,9,11,12,17-hexahydro-5H-cyclopenta[a]phenanthren-7-yl] acetate
InChI:
InChI=1S/C28H34O5/c1-16(29)33-23-14-20-25(2,3)22(31)8-11-26(20,4)19-7-10-27(5)21(28(19,23)6)13-18(30)24(27)17-9-12-32-15-17/h8-9,11-13,15,19-20,23-24H,7,10,14H2,1-6H3/t19-,20+,23-,24-,26-,27-,28-/m1/s1
InChI Key:
KWAMDQVQFVBEAU-HMWIRDDCSA-N
Properties
Complexity:
975
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
7
Defined Bond Stereocenter Count:
0
Exact Mass:
450.241g/mol
Formal Charge:
0
Heavy Atom Count:
33
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
450.575g/mol
Monoisotopic Mass:
450.241g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
73.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
Literature
| Title | Journal |
|---|---|
| Cytotoxic and apoptosis-inducing activities of limonoids from the seeds of Azadirachta indica (neem). | Journal of natural products 20110425 |
| Antiplasmodial triterpenoids from the fruits of neem, Azadirachta indica. | Journal of natural products 20100827 |
| Insect antifeedant activity of tetranortriterpenoids from the Rutales. A perusal of structural relations. | Journal of agricultural and food chemistry 20020731 |
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