input word = C00033388

Metabolite InformationStructural formula
Name Staminolactone B
(-)-Staminolactone B
Formula C38H42O12
Mw 690.26762681
CAS RN 250345-37-0
C_ID C00033388 ,
InChIKey RNTVZXREBCHYPP-ZZRVNUMXNA-N
InChICode InChI=1S/C38H42O12/c1-8-24-27(47-32(42)22-15-11-9-12-16-22)29-36(6)25(19-26(41)38(29)49-34(44)37(24,7)50-38)35(4,5)30(46-21(3)40)28(45-20(2)39)31(36)48-33(43)23-17-13-10-14-18-23/h8-18,24-31,41H,1,19H2,2-7H3/t24-,25-,26+,27+,28-,29+,30+,31-,36-,37+,38-/m0/s1
SMILES C=C[C@H]1[C@@H](OC(=O)c2ccccc2)[C@H]2[C@]3(OC(=O)[C@]1(C)O3)[C@H](O)C[C@H]1C(C)(C)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H](OC(=O)c3ccccc3)[C@@]12C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeOrthosiphon stamineus Ref.
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