(Q82977012)

English

2-Hydroxy-11,15-dioxo-12,20-epoxypregn-5-en-3-yl 2,6-dideoxy-3-o-methylhexopyranoside

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

pregnane steroid

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mass

504.27231824 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₈H₄₀O₈

0 references

canonical SMILES

O=C1CC2C(OC3C(=O)C4C(CC=C5CC(OC6OC(C)C(O)C(OC)C6)C(O)CC54C)C1C32C)C

0 references

found in taxon

Digitalis canariensis

1 reference

stated in

Die Glykoside der Blätter von Digitalis canariensis L., var. isabelliana (WEBB) LINDINGER

Canary Island Foxglove

1 reference

stated in

Die Glykoside der Blätter von Digitalis canariensis L., var. isabelliana (WEBB) LINDINGER

Identifiers

InChI

InChI=1S/C28H40O8/c1-12-16-9-17(29)22-15-7-6-14-8-19(36-21-10-20(33-5)24(31)13(2)34-21)18(30)11-27(14,3)23(15)25(32)26(35-12)28(16,22)4/h6,12-13,15-16,18-24,26,30-31H,7-11H2,1-5H3

0 references

InChIKey

QEFALKLEMZRSQY-UHFFFAOYSA-N

0 references

1 reference

5 April 2021

https://commonchemistry.cas.org/detail?cas_rn=6877-39-0

InChIKey

QEFALKLEMZRSQY-UHFFFAOYSA-N

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

QEFALKLEMZRSQY-UHFFFAOYSA-N

1 reference

1 reference

matched by identifier from

InChIKey

QEFALKLEMZRSQY-UHFFFAOYSA-N

DSSTOX compound identifier

DTXCID801415610

0 references

(Q82977012)

2-Hydroxy-11,15-dioxo-12,20-epoxypregn-5-en-3-yl 2,6-dideoxy-3-o-methylhexopyranoside

Statements

Identifiers

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