(Q104914124)

English

[(4aR,5R,6aS,7S,11aS,11bR)-4a-hydroxy-4,4,7,11b-tetramethyl-2,3,5,6,6a,7,11,11a-octahydro-1H-naphtho[2,1-f][1]benzofuran-5-yl] acetate

chemical compound

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instance of

type of chemical entity

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subclass of

(4a-hydroxy-4,4,7,11b-tetramethyl-2,3,5,6,6a,7,11,11a-octahydro-1H-naphtho[2,1-f][1]benzofuran-5-yl) acetate

1 reference

based on heuristic

inferred from SMILES

mass

360.230059504 dalton

1 reference

1 reference

inferred from InChIKey

[(4aS,5R,6aR,7S,11aR,11bS)-4a-hydroxy-4,4,7,11b-tetramethyl-2,3,5,6,6a,7,11,11a-octahydro-1H-naphtho[2,1-f][1]benzofuran-5-yl] acetate

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₂₂H₃₂O₄

0 references

canonical SMILES

O=C(OC1CC2C(C=3C=COC3CC2C4(C)CCCC(C)(C)C14O)C)C

0 references

isomeric SMILES

CC(=O)O[C@@H]1C[C@H]2[C@H](C)c3ccoc3C[C@@H]2[C@@]2(C)CCCC(C)(C)[C@]12O

0 references

found in taxon

Alpinia pulcherrima

1 reference

stated in

A New Furanoid Diterpene from Caesalpinia pulcherrima

Caesalpinia pulcherrima

1 reference

stated in

A New Furanoid Diterpene from Caesalpinia pulcherrima

Identifiers

InChI

InChI=1S/C22H32O4/c1-13-15-7-10-25-18(15)12-17-16(13)11-19(26-14(2)23)22(24)20(3,4)8-6-9-21(17,22)5/h7,10,13,16-17,19,24H,6,8-9,11-12H2,1-5H3/t13-,16+,17+,19-,21-,22-/m1/s1

0 references

InChIKey

ALHFWFVPZTXDOE-DCBGGEIISA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

ALHFWFVPZTXDOE-DCBGGEIISA-N

(Q104914124)

[(4aR,5R,6aS,7S,11aS,11bR)-4a-hydroxy-4,4,7,11b-tetramethyl-2,3,5,6,6a,7,11,11a-octahydro-1H-naphtho[2,1-f][1]benzofuran-5-yl] acetate

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