input word = C00023897

Metabolite InformationStructural formula
Name Cephalosporin P1
Formula C33H50O8
Mw 574.35056857
CAS RN 13258-72-5
C_ID C00023897 ,
InChIKey YJJWILCYIMMPAS-XFYKWXKONA-N
InChICode InChI=1S/C33H50O8/c1-17(2)10-9-11-21(30(38)39)26-22-12-13-25-31(6)15-14-23(36)18(3)27(31)28(41-20(5)35)29(37)33(25,8)32(22,7)16-24(26)40-19(4)34/h10,18,22-25,27-29,36-37H,9,11-16H2,1-8H3,(H,38,39)/b26-21-/t18-,22+,23-,24+,25+,27-,28-,29+,31-,32+,33-/m1/s1
SMILES C1[C@H]([C@H]([C@H]2[C@](C1)([C@H]1[C@]([C@H]([C@@H]2OC(=O)C)O)([C@@]2([C@@H](CC1)/C(=C(\CCC=C(C)C)/C(=O)O)/[C@H](C2)OC(=O)C)C)C)C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiDavidiellaceaeCladosporium acremonium Ref.
FungiDavidiellaceaeCladosporium sp. Ref.
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