(Q104924002)

English

(2R,4S)-2-[(1S,3R,6S,8R,11S,12S,15R,16R)-6-hydroxy-7,7,12,16-tetramethyl-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]-6-methylhept-5-ene-1,4-diol

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

2-(6-Hydroxy-7,7,12,16-tetramethyl-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl)-6-methylhept-5-ene-1,4-diol

1 reference

based on heuristic

inferred from SMILES

mass

458.37599546 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₀H₅₀O₃

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canonical SMILES

OCC(CC(O)C=C(C)C)C1CCC2(C)C3CCC4C(C)(C)C(O)CCC54CC35CCC12C

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isomeric SMILES

CC(C)=C[C@@H](O)C[C@@H](CO)[C@H]1CC[C@@]2(C)[C@@H]3CC[C@H]4C(C)(C)[C@@H](O)CC[C@@]45C[C@@]35CC[C@]12C

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found in taxon

Amberboa ramosa

1 reference

stated in

Tyrosinase inhibitory cycloartane type triterpenoids from the methanol extract of the whole plant of Amberboa ramosa Jafri and their structure-activity relationship

Monocyclanthus vignei

1 reference

stated in

Cycloartanes and other terpenoids and phenylpropanoids from Monocyclanthus vignei

Oligochaeta divaricata

1 reference

stated in

Tyrosinase inhibitory cycloartane type triterpenoids from the methanol extract of the whole plant of Amberboa ramosa Jafri and their structure-activity relationship

Identifiers

InChI

InChI=1S/C30H50O3/c1-19(2)15-21(32)16-20(17-31)22-9-11-28(6)24-8-7-23-26(3,4)25(33)10-12-29(23)18-30(24,29)14-13-27(22,28)5/h15,20-25,31-33H,7-14,16-18H2,1-6H3/t20-,21+,22+,23-,24-,25-,27+,28-,29+,30-/m0/s1

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InChIKey

BDEXCZWSCNDJPX-SRFRYMCVSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

BDEXCZWSCNDJPX-SRFRYMCVSA-N

(Q104924002)

(2R,4S)-2-[(1S,3R,6S,8R,11S,12S,15R,16R)-6-hydroxy-7,7,12,16-tetramethyl-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]-6-methylhept-5-ene-1,4-diol

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Identifiers

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