input word = C00015981

Metabolite InformationStructural formula
Name NA 30851A
SW 163A
Formula C34H42N2O12
Mw 670.27377482
CAS RN 221209-96-7
C_ID C00015981 ,
InChIKey AOOVQQYJUKCBCN-UHFFFAOYNA-N
InChICode InChI=1S/C34H42N2O12/c1-7-18(2)27-32(43)45-19(3)25(36-29(40)22-14-11-15-23(26(22)38)35-17-37)31(42)46-20(4)30(41)47-24(16-21-12-9-8-10-13-21)28(39)34(5,6)33(44)48-27/h8-15,17-20,24-25,27-28,38-39H,7,16H2,1-6H3,(H,35,37)(H,36,40)/t18-,19-,20-,24+,25-,27+,28+/m1/s1
SMILES C1([C@H]([C@@H](OC(=O)[C@H](OC(=O)[C@@H]([C@H](OC(=O)[C@@H](OC1=O)[C@H](C)CC)C)NC(=O)c1cccc(c1O)NC=O)C)Cc1ccccc1)O)(C)C
Start Substs in Alk. Biosynthesis (Prediction) L-Trp L-His
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces sp. SNA15896 Ref.
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