input word = C00031336

Metabolite InformationStructural formula
Name Scutellaric acid
(+)-Scutellaric acid
Formula C30H48O4
Mw 472.35526002
CAS RN 102919-76-6
C_ID C00031336 ,
InChIKey PGOYMURMZNDHNS-DSHDWPBCNA-N
InChICode InChI=1S/C30H48O4/c1-25(2)13-15-30(24(33)34)16-14-28(5)19(20(30)17-25)7-8-22-26(3)11-10-23(32)27(4,18-31)21(26)9-12-29(22,28)6/h7,20-23,31-32H,8-18H2,1-6H3,(H,33,34)/t20-,21+,22+,23+,26-,27+,28+,29+,30-/m0/s1
SMILES C1[C@H]([C@@]([C@H]2[C@](C1)([C@@H]1[C@@](CC2)([C@]2(C(=CC1)[C@H]1[C@@](CC2)(CCC(C1)(C)C)C(=O)O)C)C)C)(CO)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeGesneriaceaeConandron ramondioides Sieb.et Zucc. Ref.
PlantaeRubiaceaeCoussarea brevicaulis Ref.
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