(Q72507419)

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Serratenediol

chemical compound

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instance of

type of chemical entity

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1 reference

(3S,6R,11R,12R,15R,16R,21R)-3,7,7,11,16,20,20-heptamethylpentacyclo[13.8.0.03,12.06,11.016,21]tricos-1(23)-ene-8,19-diol

1 reference

based on heuristic

inferred from SMILES

(3S,8S,11R,15S,21R)-3,7,7,11,16,20,20-heptamethylpentacyclo[13.8.0.03,12.06,11.016,21]tricos-1(23)-ene-8,19-diol

1 reference

based on heuristic

inferred from SMILES

mass

442.38108084 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(3S,6R,8S,11R,12S,15R,16R,19R,21R)-3,7,7,11,16,20,20-heptamethylpentacyclo[13.8.0.03,12.06,11.016,21]tricos-1(23)-ene-8,19-diol

1 reference

based on heuristic

inferred from InChI

(1S,6R,8R,11R,12S,15S,16R,19S,21R)-1,7,7,11,16,20,20-heptamethylpentacyclo[13.8.0.0³,¹².0⁶,¹¹.0¹⁶,²¹]tricos-3-ene-8,19-diol

1 reference

based on heuristic

inferred from InChI

(3S,6R,8S,11R,12S,15S,16R,19S,21S)-3,7,7,11,16,20,20-heptamethylpentacyclo[13.8.0.03,12.06,11.016,21]tricos-1(23)-ene-8,19-diol

1 reference

1 reference

C₃₀H₅₀O₂

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canonical SMILES

OC1CCC2(C)C3C(=CCC2C1(C)C)CC4(C)CCC5C(C)(C)C(O)CCC5(C)C4CC3

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isomeric SMILES

C[C@@]12CC[C@@H]3[C@@]([C@H]1CC[C@H]4C(=CC[C@@H]5[C@@]4(CC[C@@H](C5(C)C)O)C)C2)(CC[C@@H](C3(C)C)O)C

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found in taxon

Phlegmariurus megastachyus

1 reference

stated in

Triterpenoid constituents of Lycopodium phlegmaria L

Huperzia serrata

1 reference

stated in

Serratene-type triterpenoids from Huperzia serrata

Lycopodium clavatum

1 reference

stated in

Triterpenoids of Lycopodium clavatum: the structure of 21-episerratriol

Lycopodiella inundata

1 reference

stated in

Lycopodium triterpenoids. 11. The structures of inundoside-A,-B,-C,-D1,-D2,-E,-F, and -G, triterpenoid-glycosides occurring in Lycopodium inundatum L.

Huperzia lucidula

1 reference

stated in

The Triterpenes of Lycopodiumlucidulum Michx.

Picea jezoensis

2 references

stated in

21α-hydroxy-3β-methoxyserrat-14-en-30-al and other triterpenoids from the cuticle of Picea jezoensis

stated in

Polyfunctional triterpenoids from the bark of Yeddo spruce

Pinus armandii

1 reference

stated in

Serratene triterpenes from Pinus armandii bark

Penepodium complanatum

1 reference

stated in

Triterpene constituents of Lycopodium complanatum L. from New Guinea

Abies

1 reference

stated in

Polyfunctional triterpenoids from the bark of Yeddo spruce

Identifiers

InChI

InChI=1S/C30H50O2/c1-26(2)21-10-8-19-18-28(5)15-12-22-27(3,4)25(32)14-17-30(22,7)23(28)11-9-20(19)29(21,6)16-13-24(26)31/h8,20-25,31-32H,9-18H2,1-7H3/t20-,21-,22-,23-,24-,25-,28-,29+,30-/m0/s1

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InChIKey

FMUNNDDBCLRMSL-PIGMOXAFSA-N

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CAS Registry Number

2239-24-9

1 reference

InChIKey

FMUNNDDBCLRMSL-PIGMOXAFSA-N

9 April 2021

https://commonchemistry.cas.org/detail?cas_rn=2239-24-9

PubChem CID

164947

1 reference

matched by identifier from

InChIKey

FMUNNDDBCLRMSL-PIGMOXAFSA-N

1 reference

1 reference

matched by identifier from

InChIKey

FMUNNDDBCLRMSL-PIGMOXAFSA-N

DSSTOX compound identifier

DTXCID301373366

0 references

(Q72507419)

Serratenediol

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Identifiers

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