(Q113958870)

English

2-[(1S,2R)-1,2-dihydroxy-3-methylbut-3-enyl]-6-hydroxy-1-methoxy-8-methyl-10H-benzo[b][1,5]benzodioxocin-12-one

chemical compound

In more languages

default for all languages

No label defined

No description defined

edit

Statements

instance of

type of chemical entity

0 references

subclass of

2-(1,2-dihydroxy-3-methylbut-3-enyl)-6-hydroxy-1-methoxy-8-methyl-10H-benzo[b][1,5]benzodioxocin-12-one

1 reference

based on heuristic

inferred from InChIKey

mass

386.136553044 dalton

1 reference

1 reference

1 reference

C₂₁H₂₂O₇

0 references

canonical SMILES

O=C1OCC2=CC(=CC(O)=C2OC3=CC=C(C(OC)=C13)C(O)C(O)C(=C)C)C

0 references

isomeric SMILES

C=C(C)[C@@H](O)[C@@H](O)c1ccc2c(c1OC)C(=O)OCc1cc(C)cc(O)c1O2

0 references

found in taxon

Pestalotiopsis microspora

1 reference

stated in

A Gene Cluster for the Biosynthesis of Dibenzodioxocinons in the Endophyte Pestalotiopsis microspora, a Taxol Producer

Identifiers

InChI

InChI=1S/C21H22O7/c1-10(2)17(23)18(24)13-5-6-15-16(20(13)26-4)21(25)27-9-12-7-11(3)8-14(22)19(12)28-15/h5-8,17-18,22-24H,1,9H2,2-4H3/t17-,18+/m1/s1

0 references

InChIKey

HHLSDNCZICXJDV-MSOLQXFVSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

HHLSDNCZICXJDV-MSOLQXFVSA-N

ChEBI ID

220549

mapping relation type

exact match

1 reference

matched by identifier from

International Chemical Identifier

InChI

InChI=1S/C21H22O7/c1-10(2)17(23)18(24)13-5-6-15-16(20(13)26-4)21(25)27-9-12-7-11(3)8-14(22)19(12)28-15/h5-8,17-18,22-24H,1,9H2,2-4H3/t17-,18+/m1/s1

1 reference

Natural Product Atlas ID

NPA032918

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

HHLSDNCZICXJDV-MSOLQXFVSA-N

(Q113958870)

2-[(1S,2R)-1,2-dihydroxy-3-methylbut-3-enyl]-6-hydroxy-1-methoxy-8-methyl-10H-benzo[b][1,5]benzodioxocin-12-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)