input word = C00015678

Metabolite InformationStructural formula
Name Arborcandin F
Formula C61H109N13O18
Mw 1311.80135377
CAS RN 223465-81-4
C_ID C00015678 ,
InChIKey MQIALAPCCCRUBS-FSPQRPINNA-N
InChICode InChI=1S/C61H109N13O18/c1-6-8-10-12-13-14-15-17-22-26-40(78)28-29-42-55(86)66-35-50(83)65-31-30-49(82)68-41(27-23-19-16-18-21-25-39(77)24-20-11-9-7-2)56(87)71-45(34-48(63)81)58(89)72-44(33-47(62)80)57(88)67-36(3)54(85)70-43(32-46(79)53(64)84)59(90)73-52(38(5)76)61(92)74-51(37(4)75)60(91)69-42/h36-46,51-52,75-79H,6-35H2,1-5H3,(H2,62,80)(H2,63,81)(H2,64,84)(H,65,83)(H,66,86)(H,67,88)(H,68,82)(H,69,91)(H,70,85)(H,71,87)(H,72,89)(H,73,90)(H,74,92)/t36-,37-,38-,39+,40-,41+,42-,43+,44+,45-,46-,51+,52-/m1/s1
SMILES C1(=O)NCC(=O)NCCC(=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](C(=O)N[C@@H]1CC[C@@H](CCCCCCCCCCC)O)[C@@H](C)O)[C@@H](C)O)C[C@@H](O)C(=O)N)C)CC(=O)N)CC(=O)N)CCCCCCC[C@H](CCCCCC)O
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Lys L-Arg L-Ala
Organism
Kingdom Family Species Reference
--Strain SANK 17397 Ref.
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