(Q110171256)

English

Sestermobaraene A

group of stereoisomers with the chemical formula C₂₅H₄₀

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Statements

instance of

group of stereoisomers

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subclass of

chemical compound

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mass

340.31300128 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₅H₄₀

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canonical SMILES

C1=C2C3(C)CCC4C3CCC(C)(CCC5(C)CCC(C(C)C)C15)C24C

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isomeric SMILES

CC(C)[C@@H]1CC[C@]2(C)CCC3(C)CC[C@@H]4[C@H]5CC[C@]4(C)C(=C[C@@H]12)[C@]53C

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found in taxon

Streptomyces mobaraensis

1 reference

stated in

The Biosynthetic Gene Cluster for Sestermobaraenes - Discovery of a Geranylfarnesyl Diphosphate Synthase and a Multiproduct Sesterterpene Synthase from Streptomyces mobaraensis

Identifiers

InChI

InChI=1S/C25H40/c1-16(2)17-7-10-22(3)13-14-23(4)11-8-18-19-9-12-24(18,5)21(15-20(17)22)25(19,23)6/h15-20H,7-14H2,1-6H3/t17-,18+,19+,20-,22+,23?,24-,25-/m0/s1

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InChIKey

JLUYQELLOPAXIJ-KPGSVVGFSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

JLUYQELLOPAXIJ-KPGSVVGFSA-N

ChEBI ID

211612

mapping relation type

exact match

1 reference

matched by identifier from

International Chemical Identifier

InChI

InChI=1S/C25H40/c1-16(2)17-7-10-22(3)13-14-23(4)11-8-18-19-9-12-24(18,5)21(15-20(17)22)25(19,23)6/h15-20H,7-14H2,1-6H3/t17-,18+,19+,20-,22+,23?,24-,25-/m0/s1

Natural Product Atlas ID

NPA031223

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

JLUYQELLOPAXIJ-KPGSVVGFSA-N

(Q110171256)

Sestermobaraene A

Statements

Identifiers

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