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(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
(Q105155423)
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From Wikidata
group of stereoisomers with the chemical formula C₃₀H₅₀O
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Description
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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
Statements
instance of
group of stereoisomers
0 references
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
0 references
canonical SMILES
OC1CCC2(C)C3C(=CCC2C1C)C4CCC(C(C)CCC(=CC)C(C)C)C4(C)CC3
0 references
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
0 references
found in taxon
Hippophae rhamnoides
1 reference
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
0 references
InChIKey
LPZCCMIISIBREI-GOGIJTOMSA-N
0 references
PubChem CID
5315938
2 references
stated in
PubChem
retrieved
2 January 2023
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
LPZCCMIISIBREI-GOGIJTOMSA-N
UniChem compound ID
58966152
1 reference
stated in
UniChem
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(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
(Q105155423)
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