| Name |
Phoriospongin B
(+)-Phoriospongin B |
| Formula |
C52H82ClN11O15 |
| Mw |
1135.56803874 |
| CAS RN |
420086-90-4 |
| C_ID |
C00045376
, 
|
| InChIKey |
JKJFLNUKQVXKOI-VYPDUUNNNA-N |
| InChICode |
InChI=1S/C52H82ClN11O15/c1-11-16-33-52(78)79-31(9)44(63-46(72)34(56-25-65)20-26(3)4)38(67)23-40(69)57-29(7)51(77)64(10)37(17-12-2)48(74)61-42(27(5)28(6)53)49(75)60-36(22-39(54)68)47(73)62-43(30(8)66)50(76)59-35(21-32-18-14-13-15-19-32)45(71)55-24-41(70)58-33/h13-15,18-19,25-31,33-38,42-44,66-67H,11-12,16-17,20-24H2,1-10H3,(H2,54,68)(H,55,71)(H,56,65)(H,57,69)(H,58,70)(H,59,76)(H,60,75)(H,61,74)(H,62,73)(H,63,72)/t27-,28+,29-,30-,31-,33-,34-,35+,36+,37-,38+,42-,43-,44-/m1/s1 |
| SMILES |
C1[C@@H]([C@@H]([C@H](OC(=O)[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@H](N(C(=O)[C@H](NC1=O)C)C)CCC)[C@H](C)[C@@H](Cl)C)CC(=O)N)[C@@H](C)O)Cc1ccccc1)CCC)C)NC(=O)[C@H](NC=O)CC(C)C)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
L-Asp |
| Organism |
| Kingdom |
Family |
Species |
Reference |
| - | - | Callyspongia bilamellata | Ref. |
| - | - | Phoriospongia sp. | Ref. |
|
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