BENZOYLMESACONINE HYDROCHLORIDE

CAS No.
126266-38-4
CCD No.
CCD00659371
Formula
C31 H43 N O10 . Cl H . H2 O
MolWeight
644.153

Basic Information

Product Name: BENZOYLMESACONINE HYDROCHLORIDE
CAS: 126266-38-4
English Synonyms: BENZOYLMESACONINE HYDROCHLORIDE ; BENZOYLMESACONINE HYDROCHLORIDE HYDRATE
MDL Number.: MFCD08458489
H bond acceptor: 11
H bond donor: 4
Smile: CN1C[C@@]2([C@@H](C[C@@H]([C@@]34[C@@H]2[C@H]([C@@H](C31)[C@]5(C[C@@H]([C@]6(C[C@@H]4[C@]5([C@H]6OC(=O)c7ccccc7)O)O)OC)O)OC)OC)O)COC.O.Cl
InChi: InChI=1S/C31H43NO10.ClH.H2O/c1-32-14-27(15-38-2)18(33)11-19(39-3)30-17-12-28(35)20(40-4)13-29(36,21(24(30)32)22(41-5)23(27)30)31(17,37)26(28)42-25(34)16-9-7-6-8-10-16;;/h6-10,17-24,26,33,35-37H,11-15H2,1-5H3;1H;1H2/t17-,18+,19-,20-,21-,22-,23+,24?,26-,27-,28-,29-,30-,31+;;/m0../s1
InChiKey: InChIKey=XRTSTRVVIFSUJU-AXODCOLYSA-N

* If the product has intellectual property rights, a license granted is must or contact us.