input word = C00016000

Metabolite InformationStructural formula
Name 1-Hydroxycrisamicin A
Formula C32H22O13
Mw 614.10604079
CAS RN 204198-17-4
C_ID C00016000 ,
InChIKey RGOCVNGEBMGCNA-UHFFFAOYNA-N
InChICode InChI=1S/C32H22O13/c1-9-20-23(30-16(42-9)7-18(35)43-30)28(39)21-12(26(20)37)3-10(5-14(21)33)11-4-13-22(15(34)6-11)29(40)24-25(27(13)38)32(2,41)45-17-8-19(36)44-31(17)24/h3-6,9,16-17,30-31,33-34,41H,7-8H2,1-2H3/t9-,16-,17-,30+,31+,32+/m0/s1
SMILES [C@@H]12O[C@](C3=C([C@@H]1OC(=O)C2)C(=O)c1c(C3=O)cc(cc1O)c1cc2C(=O)C3=C([C@H]4[C@@H](O[C@H]3C)CC(=O)O4)C(=O)c2c(c1)O)(O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
BacteriaMicromonosporaceaeMicromonospora sp. SA246 Ref.
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