(Q110171259)

English

Sestermobaraene D

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

C=C1CCC2C3CCC4(CC5C(CCC5(C)CC1C24C)C(C)C)C3C

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isomeric SMILES

C=C1CC[C@@H]2[C@H]3CC[C@]4(C[C@H]5[C@H](C(C)C)CC[C@]5(C)C[C@H]1[C@]24C)C3C

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

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InChIKey

MFYCTKCAUBTHKB-RSJFJCBLSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

MFYCTKCAUBTHKB-RSJFJCBLSA-N

ChEBI ID

211630

mapping relation type

exact match

1 reference

matched by identifier from

International Chemical Identifier

InChI

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

Natural Product Atlas ID

NPA031226

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

MFYCTKCAUBTHKB-RSJFJCBLSA-N

(Q110171259)

Sestermobaraene D

Statements

Identifiers

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