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 CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@@H](O)[C@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeGesneriaceaeConandron ramondioides Sieb.et Zucc. Ref.
PlantaeRubiaceaeCoussarea brevicaulis Ref.
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OrganismConandron ramondioides Sieb.et Zucc.
ReferenceMiyaichi,J.Nat.Med.,60,(2006),159