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Catalog Number | ACM2065228615 |
CAS Number | 2065228-61-5 |
Molecular Weight | 527.6 |
InChI | InChI=1S/C30H41NO7/c1-4-31-14-28(15-36-2)11-10-20(32)30-18-12-17-19(37-3)13-29(35,22(26(30)31)23(33)25(28)30)21(18)24(17)38-27(34)16-8-6-5-7-9-16/h5-9,17-26,32-33,35H,4,10-15H2,1-3H3/t17-,18-,19+,20+,21-,22,23+,24+,25-,26-,28+,29-,30+/m1/s1 |
InChI Key | DQTNVONSIQDYGN-APBCSOOVSA-N |
Purity | 95%+ |
Complexity | 957 |
Covalently-Bonded Unit Count | 1 |
Defined Atom Stereocenter Count | 12 |
Exact Mass | 527.28830265 |
Heavy Atom Count | 38 |
Hydrogen Bond Acceptor Count | 8 |
Hydrogen Bond Donor Count | 3 |
Isomeric SMILES | CCN1C[C@@]2(CC[C@@H]([C@@]34[C@@H]2[C@H](C([C@H]31)[C@]5(C[C@@H]([C@H]6C[C@@H]4[C@@H]5[C@H]6OC(=O)C7=CC=CC=C7)OC)O)O)O)COC |
Monoisotopic Mass | 527.28830265 |
PhysicalState | Powder |
Rotatable Bond Count | 7 |
Topological Polar Surface Area | 109 Ų |
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