Cucurbitacin D

Catalog No: FT-0698358

CAS No: 3877-86-9

Chemical Name: Cucurbitacin D
Molecular Formula: C30H44O7
Molecular Weight: 516.7 g/mol
InChI Key: SRPHMISUTWFFKJ-QJNWWGCFSA-N
InChI: InChI=1S/C30H44O7/c1-25(2,36)12-11-21(33)30(8,37)23-19(32)14-27(5)20-10-9-16-17(13-18(31)24(35)26(16,3)4)29(20,7)22(34)15-28(23,27)6/h9,11-12,17-20,23,31-32,36-37H,10,13-15H2,1-8H3/b12-11+/t17-,18+,19-,20+,23+,27+,28-,29+,30+/m1/s1

Product pricing and availability information
Assay	Pack Size	Price	Stock
98%	1g	N/A	N/A
98%	5g	N/A	N/A
98%	Bulk Quantity	N/A	N/A

LogP:	1.48
Flash_Point:	381.4±28.0 °C
Refractive_Index:	1.582
FW:	516.666
Density:	1.2±0.1 g/cm3
Bolling_Point:	684.0±55.0 °C at 760 mmHg
Computational_Chemistry:	['1. XlogP :21 ', '2. Hydrogen Bond Donor Count :4 ', '3. Hydrogen Bond Acceptor Count :7 ', '4. Rotatable Bond Count :4 ', '5. Isotope Atom Count :8 ', '6. TPSA :132 ', '7. Heavy Atom Count :37 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :1100 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :9 ', '12. Undefined Atom Stereocenter Count :0 ', '13. Defined Bond Stereocenter Count :1 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1']
Melting_Point:	151-152ºC
PSA:	132.13000
MF:	C30H44O7
Vapor_Pressure:	0.0±4.8 mmHg at 25°C
Exact_Mass:	516.308716