(Q105121551)

English

(7R,8R,8aR)-3-[2-[(4R,5S)-5-[(2S)-butan-2-yl]-2,2,4-trimethyl-1,3-dioxolan-4-yl]ethenyl]-7,8-dihydroxy-7-methyl-8,8a-dihydro-1H-isochromen-6-one

chemical compound

In more languages

default values for all languages

No label defined

No description defined

edit

Statements

instance of

type of chemical entity

0 references

subclass of

7,8-dihydroxy-7-methyl-3-{2-[2,2,4-trimethyl-5-(sec-butyl)-1,3-dioxolan-4-yl]ethenyl}-8,8a-dihydro-1H-isochromen-6-one

1 reference

based on heuristic

inferred from SMILES

mass

392.219888744 dalton

1 reference

1 reference

(7R,8R,8aR)-3-[(E)-2-[(4R,5S)-5-[(2S)-butan-2-yl]-2,2,4-trimethyl-1,3-dioxolan-4-yl]ethenyl]-7,8-dihydroxy-7-methyl-8,8a-dihydro-1H-isochromen-6-one

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₂H₃₂O₆

0 references

canonical SMILES

O=C1C=C2C=C(OCC2C(O)C1(O)C)C=CC3(OC(OC3C(C)CC)(C)C)C

0 references

isomeric SMILES

CC[C@H](C)[C@@H]1OC(C)(C)O[C@]1(C)C=CC1=CC2=CC(=O)[C@](C)(O)[C@H](O)[C@H]2CO1

0 references

found in taxon

Penicillium sclerotiorum

1 reference

stated in

Azaphilone and isocoumarin derivatives from the endophytic fungus Penicillium sclerotiorum PSU-A13.

Identifiers

InChI

InChI=1S/C22H32O6/c1-7-13(2)19-21(5,28-20(3,4)27-19)9-8-15-10-14-11-17(23)22(6,25)18(24)16(14)12-26-15/h8-11,13,16,18-19,24-25H,7,12H2,1-6H3/t13-,16-,18+,19-,21+,22-/m0/s1

0 references

InChIKey

IWEMHAGFVAXHLO-UKQLHWCYSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

IWEMHAGFVAXHLO-UKQLHWCYSA-N

(Q105121551)

(7R,8R,8aR)-3-[2-[(4R,5S)-5-[(2S)-butan-2-yl]-2,2,4-trimethyl-1,3-dioxolan-4-yl]ethenyl]-7,8-dihydroxy-7-methyl-8,8a-dihydro-1H-isochromen-6-one

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)