(Q105288354)

English

[(1R,5aS,5bS,7aS,11aS,11bR,13S,13aR,13bR)-1-hydroxy-5b,8,8,11a,13a-pentamethyl-3-oxo-5,5a,6,7,7a,9,10,11,11b,12,13,13b-dodecahydro-1H-phenanthro[2,1-e][2]benzofuran-13-yl] acetate

chemical compound

In more languages

edit

Statements

instance of

type of chemical entity

0 references

subclass of

(1-hydroxy-5b,8,8,11a,13a-pentamethyl-3-oxo-5,5a,6,7,7a,9,10,11,11b,12,13,13b-dodecahydro-1H-phenanthro[2,1-e][2]benzofuran-13-yl) acetate

1 reference

based on heuristic

inferred from SMILES

mass

444.28757438 dalton

1 reference

2 references

inferred from InChIKey

based on heuristic

inferred from InChI

[(1S,5aR,5bS,7aR,11aS,11bR,13S,13aR,13bS)-1-hydroxy-5b,8,8,11a,13a-pentamethyl-3-oxo-5,5a,6,7,7a,9,10,11,11b,12,13,13b-dodecahydro-1H-phenanthro[2,1-e][2]benzofuran-13-yl] acetate

1 reference

based on heuristic

inferred from InChI

[(1R,5aS,5bS,7aS,11aS,11bR,13R,13aS,13bR)-1-hydroxy-5b,8,8,11a,13a-pentamethyl-3-oxo-5,5a,6,7,7a,9,10,11,11b,12,13,13b-dodecahydro-1H-phenanthro[2,1-e][2]benzofuran-13-yl] acetate

1 reference

1 reference

C₂₇H₄₀O₅

0 references

canonical SMILES

O=C1OC(O)C2C1=CCC3C4(C)CCC5C(C)(C)CCCC5(C)C4CC(OC(=O)C)C23C

0 references

isomeric SMILES

CC(=O)O[C@H]1C[C@@H]2[C@@]3(C)CCCC(C)(C)[C@@H]3CC[C@]2(C)[C@@H]2CC=C3C(=O)O[C@@H](O)[C@@H]3[C@]12C

0 references

found in taxon

Hyrtios erectus

1 reference

stated in

Sesterterpenoids from the marine sponge Hyrtios erectus

Spongia matamata

1 reference

stated in

Two new sesterterpenoids and a new 9,11-secosterol from Spongia matamata

Identifiers

InChI

InChI=1S/C27H40O5/c1-15(28)31-20-14-19-25(4)12-7-11-24(2,3)17(25)10-13-26(19,5)18-9-8-16-21(27(18,20)6)23(30)32-22(16)29/h8,17-21,23,30H,7,9-14H2,1-6H3/t17-,18-,19+,20-,21+,23+,25-,26+,27-/m0/s1

0 references

InChIKey

VLFJWLVMFJQJEU-WOTHKKTRSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

VLFJWLVMFJQJEU-WOTHKKTRSA-N

(Q105288354)

[(1R,5aS,5bS,7aS,11aS,11bR,13S,13aR,13bR)-1-hydroxy-5b,8,8,11a,13a-pentamethyl-3-oxo-5,5a,6,7,7a,9,10,11,11b,12,13,13b-dodecahydro-1H-phenanthro[2,1-e][2]benzofuran-13-yl] acetate

Statements

Identifiers

Sitelinks

Wikipedia(0 entries)

Wikibooks(0 entries)

Wikinews(0 entries)

Wikiquote(0 entries)

Wikisource(0 entries)

Wikiversity(0 entries)

Wikivoyage(0 entries)

Wiktionary(0 entries)

Multilingual sites(0 entries)