(Q110171262)

English

Sestermobaraol

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

chemical compound

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mass

358.323565964 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₅H₄₂O

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canonical SMILES

OC12CCC3C4CCC3(C)C(CC5C(CCC5(C)CC1C)C(C)C)C42C

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isomeric SMILES

CC(C)[C@@H]1CC[C@]2(C)C[C@H](C)[C@@]3(O)CC[C@@H]4[C@H]5CC[C@]4(C)[C@H](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/C25H42O/c1-15(2)17-7-10-22(4)14-16(3)25(26)12-9-18-19-8-11-23(18,5)21(13-20(17)22)24(19,25)6/h15-21,26H,7-14H2,1-6H3/t16-,17-,18+,19+,20-,21-,22+,23-,24-,25-/m0/s1

0 references

InChIKey

BEGKLIBTSVUCGB-HDDHRNPVSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

BEGKLIBTSVUCGB-HDDHRNPVSA-N

ChEBI ID

211648

mapping relation type

exact match

1 reference

matched by identifier from

International Chemical Identifier

InChI

InChI=1S/C25H42O/c1-15(2)17-7-10-22(4)14-16(3)25(26)12-9-18-19-8-11-23(18,5)21(13-20(17)22)24(19,25)6/h15-21,26H,7-14H2,1-6H3/t16-,17-,18+,19+,20-,21-,22+,23-,24-,25-/m0/s1

Natural Product Atlas ID

NPA031229

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

BEGKLIBTSVUCGB-HDDHRNPVSA-N

(Q110171262)

Sestermobaraol

Statements

Identifiers

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