(Q105155423)

English

(3S,10S,13R,17R)-4,10,13-trimethyl-17-[(Z)-5-propan-2-ylhept-5-en-2-yl]-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol

group of stereoisomers with the chemical formula C₃₀H₅₀O

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Statements

instance of

group of stereoisomers

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subclass of

4-methylstigmastane steroid

1 reference

inferred from

4-methylstigmastane steroid

mass

426.38616622 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₀H₅₀O

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canonical SMILES

OC1CCC2(C)C3C(=CCC2C1C)C4CCC(C(C)CCC(=CC)C(C)C)C4(C)CC3

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isomeric SMILES

C/C=C(/CCC(C)[C@H]1CCC2C3=CCC4C(C)[C@@H](O)CC[C@]4(C)C3CC[C@@]21C)C(C)C

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found in taxon

Hippophae rhamnoides

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stated in

Hippophae rhamnoides L.: chromatographic methods to determine chemical composition, use in traditional medicine and pharmacological effects

Betula pendula

1 reference

stated in

Triterpenoids of the leaves of Betula pendula from different growth sites

Identifiers

InChI

InChI=1S/C30H50O/c1-8-22(19(2)3)10-9-20(4)24-13-14-26-23-11-12-25-21(5)28(31)16-18-30(25,7)27(23)15-17-29(24,26)6/h8,11,19-21,24-28,31H,9-10,12-18H2,1-7H3/b22-8-/t20?,21?,24-,25?,26?,27?,28+,29-,30+/m1/s1

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InChIKey

LPZCCMIISIBREI-GOGIJTOMSA-N

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2 references

2 January 2023

inferred from InChIKey

matched by identifier from

InChIKey

LPZCCMIISIBREI-GOGIJTOMSA-N

1 reference

(Q105155423)

(3S,10S,13R,17R)-4,10,13-trimethyl-17-[(Z)-5-propan-2-ylhept-5-en-2-yl]-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol

Statements

Identifiers

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