| Name |
Amaroxocane A
(+)-Amaroxocane A |
| Formula |
C55H88O17S3 |
| Mw |
1116.51836358 |
| CAS RN |
1111098-56-6 |
| C_ID |
C00047170
, 
|
| InChIKey |
YKJFYWUVKGJDGY-VDMUCHARNA-N |
| InChICode |
InChI=1S/C55H88O17S3/c1-28(34-11-13-36-32-21-44(70-73(60,61)62)40-23-41(56)46(72-75(66,67)68)26-53(40,8)38(32)16-18-51(34,36)6)10-15-47-55(59)24-31(50(4,5)27-55)20-43(69-47)29(2)35-12-14-37-33-22-45(71-74(63,64)65)48-30(3)49(58)42(57)25-54(48,9)39(33)17-19-52(35,37)7/h28-31,34-35,37-38,40-49,56-59H,10-27H2,1-9H3,(H,60,61,62)(H,63,64,65)(H,66,67,68)/t28-,29+,30-,31-,34-,35-,37+,38+,40-,41-,42+,43-,44+,45+,46+,47+,48-,49-,51-,52-,53-,54-,55-/m1/s1 |
| SMILES |
C1[C@H]2C(=C3[C@](C1)([C@H](CC3)[C@H](C)CC[C@@H]1O[C@H](C[C@@H]3C[C@]1(CC3(C)C)O)[C@H]([C@@H]1[C@@]3([C@@H](CC1)C1=C(CC3)[C@@]3([C@@H]([C@H](C1)OS(=O)(=O)O)[C@H]([C@H]([C@H](C3)O)O)C)C)C)C)C)C[C@@H]([C@@H]1[C@@]2(C[C@@H]([C@@H](C1)O)OS(=O)(=O)O)C)OS(=O)(=O)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| - | - | Phorbas amaranthus | Ref. |
|
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