input word = C00017883

Metabolite InformationStructural formula
Name Crisamicin C
Formula C32H22O13
Mw 614.10604079
CAS RN 100630-79-3
C_ID C00017883 ,
InChIKey CHWSBZJOQBRSAL-UHFFFAOYNA-N
InChICode InChI=1S/C32H22O13/c1-9-21-24(27-17(41-9)7-19(35)43-27)26(38)22-13(25(21)37)3-11(5-15(22)33)12-4-14-23(16(34)6-12)29(40)32-30-18(8-20(36)44-30)42-10(2)31(32,45-32)28(14)39/h3-6,9-10,17-18,27,30,33-34H,7-8H2,1-2H3/t9-,10+,17-,18+,27+,30+,31-,32-/m0/s1
SMILES O1C(=O)C[C@H]2[C@@H]1C1=C([C@@H](O2)C)C(=O)c2c(C1=O)c(cc(c2)c1cc2c(c(c1)O)C(=O)[C@@]13[C@@](C2=O)([C@H](O[C@H]2[C@H]1OC(=O)C2)C)O3)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
BacteriaMicromonosporaceaeMicromonospora purpureochromogenes subsp. halotolerans Ref.
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