input word = C00048372

Metabolite InformationStructural formula
Name Cyclomarin D
(-)-Cyclomarin D
Formula C55H80N8O10
Mw 1012.59974083
CAS RN 1019858-67-3
C_ID C00048372 ,
InChIKey AHDUXXXZGSWYHF-ASIPTSGGNA-N
InChICode InChI=1S/C55H80N8O10/c1-15-55(11,12)63-28-38(37-23-19-20-24-40(37)63)46(65)44-52(70)57-39(27-33(8)29-64)49(67)56-35(10)48(66)61-45(47(73-14)36-21-17-16-18-22-36)53(71)58-42(32(6)7)54(72)62(13)41(26-31(4)5)50(68)59-43(51(69)60-44)34(9)25-30(2)3/h15-25,28,31-35,39,41-47,64-65H,1,26-27,29H2,2-14H3,(H,56,67)(H,57,70)(H,58,71)(H,59,68)(H,60,69)(H,61,66)/t33-,34-,35+,39+,41+,42+,43+,44+,45+,46-,47-/m1/s1
SMILES C1(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N([C@H]1CC(C)C)C)C(C)C)[C@@H](c1ccccc1)OC)C)C[C@H](CO)C)[C@@H](c1c2c(n(c1)C(C)(C=C)C)cccc2)O)[C@H](C)C=C(C)C
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Anthranilate L-Ala
Organism
Kingdom Family Species Reference
--Salinispora aericola CNS205 Ref.
--Salinispora arenicola Ref.
zoom in