(Q104920095)

English

(1R,2S,5S,6S,9R,10R,13S,14R,15S,17S)-14-hydroxy-5,10,13,18,18-pentamethyl-9-propan-2-yl-23-oxahexacyclo[13.6.2.01,17.02,14.05,13.06,10]tricosan-22-one

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

14-Hydroxy-5,10,13,18,18-pentamethyl-9-propan-2-yl-23-oxahexacyclo[13.6.2.01,17.02,14.05,13.06,10]tricosan-22-one

1 reference

based on heuristic

inferred from SMILES

mass

456.360345396 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

8alpha-Hydroxyfernan-25,7beta-olide

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₀H₄₈O₃

0 references

canonical SMILES

O=C1OC2CC3C(C)(C)CCCC13C4CCC5(C)C6CCC(C(C)C)C6(C)CCC5(C)C24O

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isomeric SMILES

CC(C)[C@H]1CC[C@@H]2[C@]3(C)CC[C@H]4[C@@]56CCCC(C)(C)[C@@H]5C[C@H](OC6=O)[C@]4(O)[C@@]3(C)CC[C@@]21C

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found in taxon

Adiantum caudatum

1 reference

stated in

Triterpenoids from Adiantum caudatum

Identifiers

InChI

InChI=1S/C30H48O3/c1-18(2)19-9-10-20-26(19,5)15-16-28(7)27(20,6)14-11-21-29-13-8-12-25(3,4)22(29)17-23(30(21,28)32)33-24(29)31/h18-23,32H,8-17H2,1-7H3/t19-,20+,21+,22+,23+,26-,27+,28+,29+,30+/m1/s1

0 references

InChIKey

AWKQCEWSSUBAJV-AURZDICVSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

AWKQCEWSSUBAJV-AURZDICVSA-N

(Q104920095)

(1R,2S,5S,6S,9R,10R,13S,14R,15S,17S)-14-hydroxy-5,10,13,18,18-pentamethyl-9-propan-2-yl-23-oxahexacyclo[13.6.2.01,17.02,14.05,13.06,10]tricosan-22-one

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