a-D-Glucopyranoside,3-[2-(acetyloxy)-1-methylethyl]-1,2,4,5,6,6a,7,8,9,10a-decahydro-1,5-dihydroxy-9-(methoxymethyl)-6,10a-dimethyldicyclopenta[a,d]cycloocten-4-yl 6-O-(1,1-dimethyl-2-propenyl)-, 3-acetate,[1S-[1a,3(R*),4a,5b,6b,6aa,9b,10ab]]-


Chemical Name: a-D-Glucopyranoside,3-[2-(acetyloxy)-1-methylethyl]-1,2,4,5,6,6a,7,8,9,10a-decahydro-1,5-dihydroxy-9-(methoxymethyl)-6,10a-dimethyldicyclopenta[a,d]cycloocten-4-yl 6-O-(1,1-dimethyl-2-propenyl)-, 3-acetate,[1S-[1a,3(R*),4a,5b,6b,6aa,9b,10ab]]-
CAS Number: 20108-30-9
Product Number: AG00BCJL(AGN-PC-0QRWUQ)
Synonyms:
MDL No: MFCD00070322
Molecular Formula: C36H56O12
Molecular Weight: 680.8226

Identification/Properties


Computed Properties
Molecular Weight:
680.832g/mol
XLogP3:
1
Hydrogen Bond Donor Count:
4
Hydrogen Bond Acceptor Count:
12
Rotatable Bond Count:
14
Exact Mass:
680.377g/mol
Monoisotopic Mass:
680.377g/mol
Topological Polar Surface Area:
170A^2
Heavy Atom Count:
48
Formal Charge:
0
Complexity:
1240
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
13
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


Other Analytical Data


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