(Q110178788)

English

(2R,4aS,4bS,7S)-2,7-dihydroxy-1,1,4a-trimethyl-7-propan-2-yl-2,3,4,4b,5,6-hexahydrophenanthren-9-one

chemical compound

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Statements

instance of

type of chemical entity

0 references

1 reference

318.21949482 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₀H₃₀O₃

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canonical SMILES

O=C1C=C2C(C)(C)C(O)CCC2(C)C3C1=CC(O)(CC3)C(C)C

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isomeric SMILES

CC(C)[C@]1(O)C=C2C(=O)C=C3C(C)(C)[C@H](O)CC[C@@]3(C)[C@@H]2CC1

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found in taxon

Chloranthus sessilifolius

1 reference

stated in

ent-Abietane-Type and Related Seco-/Nor-diterpenoids from the Rare Chloranthaceae Plant Chloranthus sessilifolius and Their Antineuroinflammatory Activities

Identifiers

InChI

InChI=1S/C20H30O3/c1-12(2)20(23)9-6-14-13(11-20)15(21)10-16-18(3,4)17(22)7-8-19(14,16)5/h10-12,14,17,22-23H,6-9H2,1-5H3/t14-,17-,19+,20-/m1/s1

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InChIKey

XPDBXVJRQCWAAR-SIKIZQCASA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

XPDBXVJRQCWAAR-SIKIZQCASA-N

1 reference

(Q110178788)

(2R,4aS,4bS,7S)-2,7-dihydroxy-1,1,4a-trimethyl-7-propan-2-yl-2,3,4,4b,5,6-hexahydrophenanthren-9-one

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