input word = C00024039

Metabolite InformationStructural formula
Name Scuterivulactone C2
Formula C29H38O9
Mw 530.25158281
CAS RN 112609-10-6
C_ID C00024039 ,
InChIKey BRKXSFGVJFNJSV-IBMFVTPZNA-N
InChICode InChI=1S/C29H38O9/c1-17(30)36-22-14-29(15-23(32)35-16-29)38-25(2)13-21(37-24(33)18-9-7-6-8-10-18)27(4)19(26(22,25)3)11-12-20(31)28(27,5)34/h6-10,19-22,31,34H,11-16H2,1-5H3/t19-,20-,21+,22+,25+,26+,27+,28+,29+/m1/s1
SMILES C1[C@H]([C@]([C@]2([C@H](C1)[C@@]1([C@](C[C@@H]2OC(=O)c2ccccc2)(O[C@@]2(C[C@@H]1OC(=O)C)CC(=O)OC2)C)C)C)(C)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeScutellaria rivularis Wall. Ref.
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