| Name |
Holothurin B4
(-)-Holothurin B4 |
| Formula |
C41H64O17S |
| Mw |
860.38642135 |
| CAS RN |
852469-38-6 |
| C_ID |
C00042594
, 
|
| InChIKey |
YVDSJWPQFKPSCE-NUVZKDHQNA-N |
| InChICode |
InChI=1S/C41H64O17S/c1-20-27(43)29(45)30(46)32(54-20)56-31-28(44)23(58-59(50,51)52)19-53-33(31)55-26-12-15-37(6)22-18-25(42)41-34(47)57-39(8,14-9-13-35(2,3)48)40(41,49)17-16-38(41,7)21(22)10-11-24(37)36(26,4)5/h9,13,18,20-21,23-33,42-46,48-49H,10-12,14-17,19H2,1-8H3,(H,50,51,52)/b13-9+/t20-,21-,23-,24-,25+,26+,27-,28+,29+,30-,31-,32+,33+,37-,38+,39+,40+,41-/m1/s1 |
| SMILES |
C[C@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@]4(C)C5=C[C@H](O)[C@]67C(=O)O[C@@](C)(C/C=C/C(C)(C)O)[C@@]6(O)CC[C@@]7(C)[C@@H]5CC[C@H]4C3(C)C)OC[C@@H](OS(=O)(=O)O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Animalia | Holothuriidae | Holothuria polii | Ref. |
|
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