(Q105274378)

English

(4aR,6aS,6bR,10S,12aS)-10-hydroxy-2,2,4a,6a,6b,9,9,12a-octamethyl-3,4,5,6,6a,7,8,8a,10,11,12,14b-dodecahydro-1H-picen-13-one

group of stereoisomers with the chemical formula C₃₀H₄₈O₂

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Statements

instance of

group of stereoisomers

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subclass of

(4aR,6bR,10S,12aS)-10-hydroxy-2,2,4a,6a,6b,9,9,12a-octamethyl-3,4,5,6,7,8,8a,10,11,12,12b,14b-dodecahydro-1H-picen-13-one

1 reference

based on heuristic

inferred from SMILES

mass

440.365430776 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₀H₄₈O₂

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canonical SMILES

O=C1C=C2C3CC(C)(C)CCC3(C)CCC2(C)C4(C)CCC5C(C)(C)C(O)CCC5(C)C14

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isomeric SMILES

CC1(C)CC[C@]2(C)CC[C@]3(C)C(=CC(=O)C4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@]43C)C2C1

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found in taxon

Esenbeckia grandiflora

1 reference

stated in

Alcaloides β-indolopiridoquinazolínicos de Esenbeckia grandiflora mart. (Rutaceae)

Identifiers

InChI

InChI=1S/C30H48O2/c1-25(2)13-14-27(5)15-16-29(7)19(20(27)18-25)17-21(31)24-28(6)11-10-23(32)26(3,4)22(28)9-12-30(24,29)8/h17,20,22-24,32H,9-16,18H2,1-8H3/t20?,22?,23-,24?,27+,28-,29+,30+/m0/s1

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InChIKey

UKAIYBGRLWQHDQ-VCUIEPQISA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

UKAIYBGRLWQHDQ-VCUIEPQISA-N

1 reference

(Q105274378)

(4aR,6aS,6bR,10S,12aS)-10-hydroxy-2,2,4a,6a,6b,9,9,12a-octamethyl-3,4,5,6,6a,7,8,8a,10,11,12,14b-dodecahydro-1H-picen-13-one

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Identifiers

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