(Q105130262)

English

[(1S,2R,5S,7R,9S,10S,15R,16R)-10-acetyloxy-2,16-dimethyl-15-[(2R)-6-methyl-5-methylideneheptan-2-yl]-8-oxapentacyclo[9.7.0.02,7.07,9.012,16]octadec-11-en-5-yl] acetate

chemical compound

In more languages

edit

Statements

instance of

type of chemical entity

0 references

subclass of

5-(acetyloxy)-2,16-dimethyl-15-(6-methyl-5-methylideneheptan-2-yl)-8-oxapentacyclo[9.7.0.0²,⁷.0⁷,⁹.0¹²,¹⁶]octadec-11-en-10-yl acetate

1 reference

based on heuristic

inferred from SMILES

mass

512.350174636 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₂H₄₈O₅

0 references

canonical SMILES

O=C(OC1C2=C3CCC(C(C)CCC(=C)C(C)C)C3(C)CCC2C4(C)CCC(OC(=O)C)CC54OC15)C

0 references

isomeric SMILES

C=C(CC[C@@H](C)[C@H]1CCC2=C3[C@H](OC(C)=O)[C@@H]4O[C@@]45C[C@@H](OC(C)=O)CC[C@]5(C)[C@H]3CC[C@@]21C)C(C)C

0 references

found in taxon

Spongia officinalis

1 reference

stated in

New delta 8- and delta 8(14)-5 alpha,6 alpha-epoxysterols from the marine sponge Spongia officinalis

Identifiers

InChI

InChI=1S/C32H48O5/c1-18(2)19(3)9-10-20(4)24-11-12-25-27-26(14-15-30(24,25)7)31(8)16-13-23(35-21(5)33)17-32(31)29(37-32)28(27)36-22(6)34/h18,20,23-24,26,28-29H,3,9-17H2,1-2,4-8H3/t20-,23+,24-,26+,28+,29+,30-,31-,32+/m1/s1

0 references

InChIKey

JKIYNBUXHQKUNJ-OHZLGMGYSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

JKIYNBUXHQKUNJ-OHZLGMGYSA-N

(Q105130262)

[(1S,2R,5S,7R,9S,10S,15R,16R)-10-acetyloxy-2,16-dimethyl-15-[(2R)-6-methyl-5-methylideneheptan-2-yl]-8-oxapentacyclo[9.7.0.02,7.07,9.012,16]octadec-11-en-5-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)