(Q110168493)

English

Truncateol M

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

chemical compound

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mass

330.123401516 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₆H₂₃ClO₅

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canonical SMILES

O=C1C2=C(OC(C)(C)C1)C(Cl)C3(O)CC(OC3C2)C(O)(C)C

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isomeric SMILES

CC1(C)CC(=O)C2=C(O1)[C@H](Cl)[C@]1(O)C[C@H](C(C)(C)O)O[C@H]1C2

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found in taxon

Truncatella angustata

1 reference

stated in

Truncateols A–N, new isoprenylated cyclohexanols from the sponge-associated fungus Truncatella angustata with anti-H1N1 virus activities

Identifiers

InChI

InChI=1S/C16H23ClO5/c1-14(2)6-9(18)8-5-10-16(20,13(17)12(8)22-14)7-11(21-10)15(3,4)19/h10-11,13,19-20H,5-7H2,1-4H3/t10-,11+,13-,16-/m0/s1

0 references

InChIKey

MXWYBIVSOJBCAK-DZJQYVJYSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

MXWYBIVSOJBCAK-DZJQYVJYSA-N

ChEBI ID

209914

mapping relation type

exact match

1 reference

matched by identifier from

International Chemical Identifier

InChI

InChI=1S/C16H23ClO5/c1-14(2)6-9(18)8-5-10-16(20,13(17)12(8)22-14)7-11(21-10)15(3,4)19/h10-11,13,19-20H,5-7H2,1-4H3/t10-,11+,13-,16-/m0/s1

Natural Product Atlas ID

NPA014063

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

MXWYBIVSOJBCAK-DZJQYVJYSA-N

(Q110168493)

Truncateol M

Statements

Identifiers

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