19-HYDROXYBACCATIN III

CAS No.
78432-78-7
CCD No.
CCD03477427
Formula
C31 H38 O12
MolWeight
602.629

Basic Information

Product Name: 19-HYDROXYBACCATIN III
CAS: 78432-78-7
English Synonyms: 19-HYDROXYBACCATIN III
MDL Number.: MFCD17214887
H bond acceptor: 12
H bond donor: 4
Smile: CC1=C2[C@H](C(=O)[C@@]3([C@H](C[C@@H]4[C@]([C@H]3[C@@H]([C@@](C2(C)C)(C[C@@H]1O)O)OC(=O)c5ccccc5)(CO4)OC(=O)C)O)CO)OC(=O)C
InChi: InChI=1S/C31H38O12/c1-15-19(35)12-31(39)26(42-27(38)18-9-7-6-8-10-18)24-29(13-32,20(36)11-21-30(24,14-40-21)43-17(3)34)25(37)23(41-16(2)33)22(15)28(31,4)5/h6-10,19-21,23-24,26,32,35-36,39H,11-14H2,1-5H3/t19-,20-,21+,23+,24-,26-,29+,30-,31+/m0/s1
InChiKey: InChIKey=SYDMVWLQJZBPIU-VHLOTGQHSA-N

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