(Q105224149)

English

2-[(1S,4aS,10aS)-7-(2-hydroxypropan-2-yl)-1,4a-dimethyl-2,3,4,9,10,10a-hexahydrophenanthren-1-yl]acetic acid

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

chemical compound

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mass

330.21949482 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₁H₃₀O₃

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canonical SMILES

O=C(O)CC1(C)CCCC2(C3=CC=C(C=C3CCC21)C(O)(C)C)C

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isomeric SMILES

CC(C)(O)c1ccc2c(c1)CC[C@H]1[C@](C)(CC(=O)O)CCC[C@]21C

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found in taxon

Pinus luchuensis

1 reference

stated in

Potential antitumor-promoting diterpenes from the cones of Pinus luchuensis

Identifiers

InChI

InChI=1S/C21H30O3/c1-19(2,24)15-7-8-16-14(12-15)6-9-17-20(3,13-18(22)23)10-5-11-21(16,17)4/h7-8,12,17,24H,5-6,9-11,13H2,1-4H3,(H,22,23)/t17-,20-,21+/m0/s1

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InChIKey

QMTZBWPBIQZLBJ-DZFGPLHGSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

QMTZBWPBIQZLBJ-DZFGPLHGSA-N

1 reference

(Q105224149)

2-[(1S,4aS,10aS)-7-(2-hydroxypropan-2-yl)-1,4a-dimethyl-2,3,4,9,10,10a-hexahydrophenanthren-1-yl]acetic acid

Statements

Identifiers

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