| Name |
Papuamide D |
| Formula |
C65H100N12O21 |
| Mw |
1384.71259835 |
| CAS RN |
240427-06-9 |
| C_ID |
C00039926
, 
|
| InChIKey |
JHMVDIYMGNHGMP-GKLLMMNVNA-N |
| InChICode |
InChI=1S/C65H100N12O21/c1-15-32(5)27-33(6)20-25-44(81)65(12,95)64(94)68-29-46(83)72-48(37(10)78)59(89)70-41(16-2)57(87)73-47(34(7)35(8)54(66)84)58(88)75-50-52(31(3)4)98-63(93)43-19-17-18-26-77(43)62(92)51(53(97-14)39-21-23-40(80)24-22-39)76-60(90)49(38(11)79)74-55(85)36(9)69-45(82)28-67-56(86)42(30-96-13)71-61(50)91/h16,20-25,27,31-32,34-38,42-44,47-53,78-81,95H,15,17-19,26,28-30H2,1-14H3,(H2,66,84)(H,67,86)(H,68,94)(H,69,82)(H,70,89)(H,71,91)(H,72,83)(H,73,87)(H,74,85)(H,75,88)(H,76,90)/b25-20-,33-27+,41-16-/t32-,34+,35-,36+,37-,38-,42-,43+,44+,47-,48+,49+,50+,51-,52-,53+,65+/m1/s1 |
| SMILES |
C/C=C(NC(=O)C(NC(=O)CNC(=O)C(C)(O)C(O)/C=CC(C)=CC(C)CC)[C@@H](C)O)C(=O)N[C@@H](C(=O)N[C@@H]1C(=O)N[C@H](COC)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H]([C@@H](C)O)C(=O)NC(C(OC)c2ccc(O)cc2)C(=O)N2CCCC[C@H]2C(=O)O[C@@H]1C(C)C)[C@@H](C)[C@@H](C)C(N)=O |
| Start Substs in Alk. Biosynthesis (Prediction) |
L-Lys |
| Organism |
| Kingdom |
Family |
Species |
Reference |
| - | - | Theonella swinhoei | Ref. |
|
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