InChI: |
1S/C56H98O35/c1-64-15-22-36-29(57)43(71-8)50(78-22)86-37-23(16-65-2)80-52(45(73-10)30(37)58)88-39-25(18-67-4)82-54(47(75-12)32(39)60)90-41-27(20-69-6)84-56(49(77-14)34(41)62)91-42-28(21-70-7)83-55(48(76-13)35(42)63)89-40-26(19-68-5)81-53(46(74-11)33(40)61)87-38-24(17-66-3)79-51(85-36)44(72-9)31(38)59/h22-63H,15-21H2,1-14H3/t22?,23?,24?,25?,26?,27?,28?,29-,30-,31-,32-,33-,34-,35-,36+,37+,38+,39+,40+,41+,42+,43?,44?,45?,46?,47?,48?,49?,50-,51+,52+,53+,54+,55+,56+/m0/s1 |
InChIKey: |
QGKBSGBYSPTPKJ-PYHLCDSOSA-N |
|
H donor: |
7 |
H acceptor: |
35 |
Rotatable bond: |
35 |
Stereocenter: |
35 |
|
cLogP: |
-6.122 |
cLogS: |
-0.222 |
Polar surface: |
400.05 |
|