(Q105165735)

English

(1R,2S,5S,8R,9R,17S)-17-hydroxy-9,13,13-trimethyl-4-methylidene-16-oxapentacyclo[7.6.1.12,5.02,8.010,14]heptadec-10(14)-ene-3,11-dione

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

17-Hydroxy-9,13,13-trimethyl-4-methylidene-16-oxapentacyclo[7.6.1.12,5.02,8.010,14]heptadec-10(14)-ene-3,11-dione

1 reference

based on heuristic

inferred from SMILES

mass

328.167459248 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(1R,2S,5S,8R,9R,17R)-17-hydroxy-9,13,13-trimethyl-4-methylidene-16-oxapentacyclo[7.6.1.12,5.02,8.010,14]heptadec-10(14)-ene-3,11-dione

2 references

based on heuristic

inferred from InChIKey

2 references

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₂₀H₂₄O₄

0 references

canonical SMILES

O=C1C2=C(CC3OC2(C)C4CCC5C(=C)C(=O)C34C5O)C(C)(C)C1

0 references

isomeric SMILES

C=C1C(=O)[C@]23[C@@H](O)[C@H]1CC[C@H]2[C@@]1(C)O[C@@H]3CC2=C1C(=O)CC2(C)C

0 references

found in taxon

Croton kongensis

1 reference

stated in

Crotonkinensins A and B, diterpenoids from the Vietnamese medicinal plant Croton tonkinensis

Identifiers

InChI

InChI=1S/C20H24O4/c1-9-10-5-6-13-19(4)15-11(18(2,3)8-12(15)21)7-14(24-19)20(13,16(9)22)17(10)23/h10,13-14,17,23H,1,5-8H2,2-4H3/t10-,13-,14+,17-,19+,20-/m0/s1

0 references

InChIKey

MJXXHOYVYOQSOU-UOGBALLZSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

MJXXHOYVYOQSOU-UOGBALLZSA-N

(Q105165735)

(1R,2S,5S,8R,9R,17S)-17-hydroxy-9,13,13-trimethyl-4-methylidene-16-oxapentacyclo[7.6.1.12,5.02,8.010,14]heptadec-10(14)-ene-3,11-dione

Statements

Identifiers

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