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148044-47-7 | 9,19-Cyclolanost-23-en-3-one, 25-hydroxy-
CAS No: 148044-47-7 Catalog No: AG001FDU MDL No:MFCD20274860
Product Description
Catalog Number:
AG001FDU
Chemical Name:
9,19-Cyclolanost-23-en-3-one, 25-hydroxy-
CAS Number:
148044-47-7
MDL Number:
MFCD20274860
IUPAC Name:
(1S,3R,8R,11S,12S,15R,16R)-15-[(E,2R)-6-hydroxy-6-methylhept-4-en-2-yl]-7,7,12,16-tetramethylpentacyclo[9.7.0.01,3.03,8.012,16]octadecan-6-one
InChI:
InChI=1S/C30H48O2/c1-20(9-8-14-25(2,3)32)21-12-15-28(7)23-11-10-22-26(4,5)24(31)13-16-29(22)19-30(23,29)18-17-27(21,28)6/h8,14,20-23,32H,9-13,15-19H2,1-7H3/b14-8+/t20-,21-,22+,23+,27-,28+,29-,30+/m1/s1
InChI Key:
FQNGHHPZIYLPNI-DYWBVCMMSA-N
Properties
Complexity:
838
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
8
Defined Bond Stereocenter Count:
1
Exact Mass:
440.365g/mol
Formal Charge:
0
Heavy Atom Count:
32
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
440.712g/mol
Monoisotopic Mass:
440.365g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.6
Literature
| Title | Journal |
|---|---|
| Cancer chemopreventive effects of cycloartane-type and related triterpenoids in in vitro and in vivo models. | Journal of natural products 20070601 |
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