(Q110170903)

English

Napyradiomycin A3

group of stereoisomers with the chemical formula C₂₅H₃₀O₇

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Statements

instance of

group of stereoisomers

0 references

subclass of

chemical compound

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mass

442.1991533 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₅H₃₀O₇

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canonical SMILES

O=C1C=2C(O)=CC(O)=CC2C(=O)C3(OC(C)(C)C(O)C=C13)CC=C(C)CCC(O)C(=C)C

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isomeric SMILES

C=C(C)C(O)CCC(C)=CC[C@@]12OC(C)(C)[C@@H](O)C=C1C(=O)c1c(O)cc(O)cc1C2=O

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found in taxon

Streptomyces

1 reference

stated in

New Napyradiomycin Analogues from Streptomyces sp. Strain CA-271078

Identifiers

InChI

InChI=1S/C25H30O7/c1-13(2)18(27)7-6-14(3)8-9-25-17(12-20(29)24(4,5)32-25)22(30)21-16(23(25)31)10-15(26)11-19(21)28/h8,10-12,18,20,26-29H,1,6-7,9H2,2-5H3/t18?,20-,25+/m0/s1

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InChIKey

BPLKXUXDARUPCB-MNISZPLNSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

BPLKXUXDARUPCB-MNISZPLNSA-N

ChEBI ID

209527

mapping relation type

exact match

1 reference

matched by identifier from

International Chemical Identifier

InChI

InChI=1S/C25H30O7/c1-13(2)18(27)7-6-14(3)8-9-25-17(12-20(29)24(4,5)32-25)22(30)21-16(23(25)31)10-15(26)11-19(21)28/h8,10-12,18,20,26-29H,1,6-7,9H2,2-5H3/t18?,20-,25+/m0/s1

Natural Product Atlas ID

NPA030870

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

BPLKXUXDARUPCB-MNISZPLNSA-N

(Q110170903)

Napyradiomycin A3

Statements

Identifiers

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