(Q105006717)

English

(1S,2R,3S,5S,8S,11S)-2-hydroxy-1-methyl-6-propan-2-yl-4,14-dioxapentacyclo[9.7.0.02,8.03,5.012,16]octadeca-6,12(16)-dien-15-one

chemical compound

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instance of

type of chemical entity

0 references

subclass of

chemical compound

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mass

330.183109312 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₀H₂₆O₄

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canonical SMILES

O=C1OCC2=C1CCC3(C)C2CCC4C=C(C5OC5C43O)C(C)C

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isomeric SMILES

CC(C)C1=C[C@@H]2CC[C@H]3C4=C(CC[C@]3(C)[C@@]2(O)[C@H]2O[C@@H]12)C(=O)OC4

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found in taxon

Stemodia maritima

1 reference

stated in

Diterpene and other constituents from Stemodia maritima (Scrophulariaceae)

Identifiers

InChI

InChI=1S/C20H26O4/c1-10(2)13-8-11-4-5-15-14-9-23-18(21)12(14)6-7-19(15,3)20(11,22)17-16(13)24-17/h8,10-11,15-17,22H,4-7,9H2,1-3H3/t11-,15-,16-,17-,19-,20-/m0/s1

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InChIKey

GDHKFZBGWUQLOC-KWOMQRLGSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

GDHKFZBGWUQLOC-KWOMQRLGSA-N

(Q105006717)

(1S,2R,3S,5S,8S,11S)-2-hydroxy-1-methyl-6-propan-2-yl-4,14-dioxapentacyclo[9.7.0.02,8.03,5.012,16]octadeca-6,12(16)-dien-15-one

Statements

Identifiers

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