input word = C00006296

Metabolite InformationStructural formula
Name Embinoidin
Formula C29H34O15
Mw 622.18977042
CAS RN 88721-10-2
C_ID C00006296 ,
InChIKey NFERLOPAIHIYNM-QYCMDZKQNA-N
InChICode InChI=1S/C29H34O15/c1-39-12-5-3-11(4-6-12)14-7-13(32)19-16(41-14)8-15(40-2)20(23(19)35)27-28(25(37)22(34)17(9-30)42-27)44-29-26(38)24(36)21(33)18(10-31)43-29/h3-8,17-18,21-22,24-31,33-38H,9-10H2,1-2H3/t17-,18+,21-,22-,24+,25+,26-,27+,28-,29+/m1/s1
SMILES c1(c(c(c2c(c1)oc(cc2=O)c1ccc(cc1)OC)O)[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@@H](O1)CO)O)O)O)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAcanthaceaeSiphonoglossa sessilis Ref.
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