input word = C00037879

Metabolite InformationStructural formula
Name Taibairubescensin B
Formula C24H34O7
Mw 434.23045344
CAS RN 263910-38-9
C_ID C00037879 ,
InChIKey QIVPXCIOMAEZGZ-IZKNUIGQNA-N
InChICode InChI=1S/C24H34O7/c1-11-14-7-17(30-12(2)25)19-23(6)9-16(28)21(31-13(3)26)22(4,5)18(23)15(27)10-24(19,8-14)20(11)29/h14-19,21,27-28H,1,7-10H2,2-6H3/t14-,15+,16+,17+,18-,19+,21+,23-,24+/m1/s1
SMILES C=C1C(=O)[C@]23C[C@H]1C[C@H](OC(C)=O)[C@H]2[C@]1(C)C[C@H](O)[C@H](OC(C)=O)C(C)(C)[C@H]1[C@@H](O)C3
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeIsodon rubescens Ref.
PlantaeLamiaceaeRabdosia rubescens Ref.
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OrganismRabdosia rubescens
ReferenceLi, et al., Phytochemistry, 53, (2000), 855.

Sun, et al., Diterpenoids from Isodon Species, Science Press, Beijing, (2001)