(Q104967257)

English

(1S,2S,3R,5S,8S,11S,13S,14R,17S,20R)-3,13-dihydroxy-14-methyl-6-methylidene-10,16,18-trioxahexacyclo[12.5.1.15,8.01,11.02,8.017,20]henicosane-7,9-dione

chemical compound

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instance of

type of chemical entity

0 references

subclass of

chemical compound

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mass

376.152203108 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₀H₂₄O₇

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canonical SMILES

O=C1OC2CC(O)C3(C)COC4OCC2(C43)C5C(O)CC6C(=C)C(=O)C15C6

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isomeric SMILES

C=C1C(=O)[C@]23C[C@H]1C[C@@H](O)[C@H]2[C@]12CO[C@@H]4OC[C@](C)([C@@H](O)C[C@@H]1OC3=O)[C@@H]42

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found in taxon

Isodon sculponeatus

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stated in

6,7-seco-ent-kaurane diterpenoids from Isodon sculponeatus with cytotoxic activity

Identifiers

InChI

InChI=1S/C20H24O7/c1-8-9-3-10(21)13-19(5-9,15(8)23)17(24)27-12-4-11(22)18(2)6-25-16-14(18)20(12,13)7-26-16/h9-14,16,21-22H,1,3-7H2,2H3/t9-,10-,11+,12+,13-,14-,16+,18-,19+,20+/m1/s1

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InChIKey

CORVIGTUSONGEO-FWYYDOJKSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

CORVIGTUSONGEO-FWYYDOJKSA-N

(Q104967257)

(1S,2S,3R,5S,8S,11S,13S,14R,17S,20R)-3,13-dihydroxy-14-methyl-6-methylidene-10,16,18-trioxahexacyclo[12.5.1.15,8.01,11.02,8.017,20]henicosane-7,9-dione

Statements

Identifiers

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