input word = C00037394

Metabolite InformationStructural formula
Name Koelpinin B
(+)-Koelpinin B
Formula C31H48O3
Mw 468.3603454
CAS RN 263169-63-7
C_ID C00037394 ,
InChIKey QPAYMQCYVQKZLP-FWOJOSGJNA-N
InChICode InChI=1S/C31H48O3/c1-18(2)20-9-10-21-23(33)17-31(8)22(27(20)21)11-12-25-29(6)15-14-26(34-19(3)32)28(4,5)24(29)13-16-30(25,31)7/h11,18,20,23-26,33H,9-10,12-17H2,1-8H3/t20-,23+,24-,25+,26-,29-,30+,31+/m0/s1
SMILES C12=C([C@@H](C[C@@]3(C1=CC[C@H]1[C@]3(CC[C@@H]3[C@@]1(CC[C@@H](C3(C)C)OC(=O)C)C)C)C)O)CC[C@H]2C(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeKoelpinia linearis Ref.
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