input word = C00024685

Metabolite InformationStructural formula
Name AT 2433B2
Formula C33H34N4O9
Mw 630.23257871
CAS RN 102622-95-7
C_ID C00024685 ,
InChIKey BPQSCNQWKTWUJX-HLCGJVNMNA-N
InChICode InChI=1S/C33H34N4O9/c1-36-31(41)24-22-14-7-3-5-9-17(14)35-26(22)27-23(25(24)32(36)42)15-8-4-6-10-18(15)37(27)33-29(40)28(39)30(43-2)20(46-33)13-45-21-11-19(38)16(34)12-44-21/h3-10,16,19-21,28-30,33,35,38-40H,11-13,34H2,1-2H3/t16-,19-,20+,21-,28+,29-,30+,33+/m0/s1
SMILES CO[C@@H]1C(CO[C@H]2C[C@H](O)[C@@H](N)CO2)O[C@@H](n2c3ccccc3c3c4c(c5c6ccccc6[nH]c5c32)C(=O)N(C)C4=O)[C@@H](O)C1O
Start Substs in Alk. Biosynthesis (Prediction) L-Trp L-Pro Secologanin IPP
Organism
Kingdom Family Species Reference
BacteriaThermomonosporaceaeActinomadura melliaura sp. Ref.
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