(Q105162247)

English

[(1S,3aR,4R,4aS,8aR,8bR)-1-hydroxy-4a,8,8,8a-tetramethyl-1,3,3a,4,5,6,7,8b-octahydroindeno[1,2-c]furan-4-yl] (Z)-3-(4-hydroxyphenyl)prop-2-enoate

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

(1-Hydroxy-4a,8,8,8a-tetramethyl-1,3,3a,4,5,6,7,8b-octahydroindeno[1,2-c]furan-4-yl) 3-(4-hydroxyphenyl)prop-2-enoate

1 reference

based on heuristic

inferred from SMILES

mass

400.224974124 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

[(1R,3aS,4S,4aR,8aS,8bS)-1-hydroxy-4a,8,8,8a-tetramethyl-1,3,3a,4,5,6,7,8b-octahydroindeno[1,2-c]furan-4-yl] (E)-3-(4-hydroxyphenyl)prop-2-enoate

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₄H₃₂O₅

0 references

canonical SMILES

O=C(OC1C2COC(O)C2C3(C)C(C)(C)CCCC13C)C=CC4=CC=C(O)C=C4

0 references

isomeric SMILES

CC1(C)CCC[C@]2(C)[C@H](OC(=O)/C=C\c3ccc(O)cc3)[C@H]3CO[C@H](O)[C@H]3[C@]12C

0 references

found in taxon

Thapsia villosa

1 reference

stated in

Non-acetalic thapsane sesquiterpenoids from Thapsia villosa var. minor

Identifiers

InChI

InChI=1S/C24H32O5/c1-22(2)12-5-13-23(3)20(17-14-28-21(27)19(17)24(22,23)4)29-18(26)11-8-15-6-9-16(25)10-7-15/h6-11,17,19-21,25,27H,5,12-14H2,1-4H3/b11-8-/t17-,19-,20+,21-,23+,24+/m0/s1

0 references

InChIKey

MEIBKHXXKNZYPZ-SQLMTIRTSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

MEIBKHXXKNZYPZ-SQLMTIRTSA-N

(Q105162247)

[(1S,3aR,4R,4aS,8aR,8bR)-1-hydroxy-4a,8,8,8a-tetramethyl-1,3,3a,4,5,6,7,8b-octahydroindeno[1,2-c]furan-4-yl] (Z)-3-(4-hydroxyphenyl)prop-2-enoate

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