(Q105289069)

English

(3S)-3-hydroxy-3,10,10,13-tetramethyl-6,11-dioxatetracyclo[7.6.1.02,7.012,16]hexadeca-1(16),2(7),4,8,12-pentaene-14,15-dione

chemical compound

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Statements

instance of

type of chemical entity

0 references

1 reference

312.099773612 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₈H₁₆O₅

0 references

canonical SMILES

O=C1C(=O)C(=C2OC(C=3C=C4OC=CC(O)(C4=C1C23)C)(C)C)C

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isomeric SMILES

CC1=C2OC(C)(C)c3cc4c(c(c32)C(=O)C1=O)[C@@](C)(O)C=CO4

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found in taxon

Bombax malabaricum

1 reference

stated in

Sesquiterpenoids from Bombax malabaricum

Bombax ceiba

1 reference

stated in

Sesquiterpenoids from Bombax malabaricum

Identifiers

InChI

InChI=1S/C18H16O5/c1-8-14(19)15(20)12-11-9(17(2,3)23-16(8)11)7-10-13(12)18(4,21)5-6-22-10/h5-7,21H,1-4H3/t18-/m0/s1

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InChIKey

VMMFPHJFSTXENR-SFHVURJKSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

VMMFPHJFSTXENR-SFHVURJKSA-N

(Q105289069)

(3S)-3-hydroxy-3,10,10,13-tetramethyl-6,11-dioxatetracyclo[7.6.1.02,7.012,16]hexadeca-1(16),2(7),4,8,12-pentaene-14,15-dione

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Identifiers

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